2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine

C74H91Cl4F10N23 — CID 159698025

About 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine

2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine (PubChem CID 159698025) has the molecular formula C74H91Cl4F10N23 and a molecular weight of 1634.49 g/mol. Its IUPAC name is 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine.

Molecular Properties

• Compound Name: 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine
• PubChem CID: 159698025
• Molecular Formula: C74H91Cl4F10N23
• Molecular Weight: 1634.49 g/mol
• Exact Mass: 1631.64
• IUPAC Name: 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine
• SMILES: Clc1ccnc(Cl)n1.FC1(F)CCC(Nc2ccnc(-n3ccc(C4CC4)n3)n2)CC1.FC1(F)CCC(Nc2ccnc(Cl)n2)CC1.FC1(F)CCC(Nc2nccc(-n3ccc(C4CC4)n3)n2)CC1.FC1(F)CCC(Nc2nccc(Cl)n2)CC1.NC1CCC(F)(F)CC1.c1cc(C2CC2)[nH]n1.c1cc(C2CC2)[nH]n1
• InChI: InChI=1S/2C16H19F2N5.2C10H12ClF2N3.C6H11F2N.2C6H8N2.C4H2Cl2N2/c17-16(18)7-3-12(4-8-16)20-15-19-9-5-14(21-15)23-10-6-13(22-23)11-1-2-11;17-16(18)7-3-12(4-8-16)20-14-5-9-19-15(21-14)23-10-6-13(22-23)11-1-2-11;11-9-14-6-3-8(16-9)15-7-1-4-10(12,13)5-2-7;11-8-3-6-14-9(16-8)15-7-1-4-10(12,13)5-2-7;7-6(8)3-1-5(9)2-4-6;2*1-2-5(1)6-3-4-7-8-6;5-3-1-2-7-4(6)8-3/h2*5-6,9-12H,1-4,7-8H2,(H,19,20,21);2*3,6-7H,1-2,4-5H2,(H,14,15,16);5H,1-4,9H2;2*3-5H,1-2H2,(H,7,8);1-2H
• InChIKey: MXGMFMRHEZKCCN-UHFFFAOYSA-N
• XLogP: 19.18
• TPSA: 296.04 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 21
• Rotatable Bonds: 14
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1634.49
LogP ≤ 5	19.18
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine?

The IUPAC name of 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine (CID 159698025) is 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine.

What is the SMILES notation for 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine?

The canonical SMILES for 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine is Clc1ccnc(Cl)n1.FC1(F)CCC(Nc2ccnc(-n3ccc(C4CC4)n3)n2)CC1.FC1(F)CCC(Nc2ccnc(Cl)n2)CC1.FC1(F)CCC(Nc2nccc(-n3ccc(C4CC4)n3)n2)CC1.FC1(F)CCC(Nc2nccc(Cl)n2)CC1.NC1CCC(F)(F)CC1.c1cc(C2CC2)[nH]n1.c1cc(C2CC2)[nH]n1.

What is the InChIKey of 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine?

The InChIKey is MXGMFMRHEZKCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H19F2N5.2C10H12ClF2N3.C6H11F2N.2C6H8N2.C4H2Cl2N2/c17-16(18)7-3-12(4-8-16)20-15-19-9-5-14(21-15)23-10-6-13(22-23)11-1-2-11;17-16(18)7-3-12(4-8-16)20-14-5-9-19-15(21-14)23-10-6-13(22-23)11-1-2-11;11-9-14-6-3-8(16-9)15-7-1-4-10(12,13)5-2-7;11-8-3-6-14-9(16-8)15-7-1-4-10(12,13)5-2-7;7-6(8)3-1-5(9)2-4-6;2*1-2-5(1)6-3-4-7-8-6;5-3-1-2-7-4(6)8-3/h2*5-6,9-12H,1-4,7-8H2,(H,19,20,21);2*3,6-7H,1-2,4-5H2,(H,14,15,16);5H,1-4,9H2;2*3-5H,1-2H2,(H,7,8);1-2H.

What are the key properties of 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine?

2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine has a molecular weight of 1634.49 g/mol, XLogP of 19.18, 14 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-chloro-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;bis(5-cyclopropyl-1H-pyrazole);2-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-4-amine;4-(3-cyclopropylpyrazol-1-yl)-N-(4,4-difluorocyclohexyl)pyrimidin-2-amine;2,4-dichloropyrimidine;4,4-difluorocyclohexan-1-amine is sourced from PubChem (CID 159698025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).