2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine

C16H23N5 — CID 50951636

IUPAC2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)CCc2ccncc2)c1C
InChIInChI=1S/C16H23N5/c1-12-13(2)18-16(20(3)4)19-15(12)21(5)11-8-14-6-9-17-10-7-14/h6-7,9-10H,8,11H2,1-5H3
InChIKeyWDZZGCPSDDHQHO-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.23
Rot. Bonds5

About 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine

2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine (PubChem CID 50951636) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
PubChem CID50951636
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)CCc2ccncc2)c1C
InChIInChI=1S/C16H23N5/c1-12-13(2)18-16(20(3)4)19-15(12)21(5)11-8-14-6-9-17-10-7-14/h6-7,9-10H,8,11H2,1-5H3
InChIKeyWDZZGCPSDDHQHO-UHFFFAOYSA-N
XLogP2.23
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine with MolForge

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Related Compounds

N,3,6-trimethyl-N-(2-pyridin-4-ylethyl)pyrazin-2-amine
CID 133468986
2-N,4-N,6-trimethyl-2-N,4-N-bis(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112921458
2-N,2-N,4-N,5,6-pentamethyl-4-N-[(3-pyridin-4-yl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine
CID 50963811
2-chloro-N,5-dimethyl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 79075884
N-methyl-3-propan-2-yloxy-N-(2-pyridin-4-ylethyl)pyrazin-2-amine
CID 133442931
4-N-tert-butyl-2-N,6-dimethyl-2-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112921587
5-fluoro-4-N-methyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 80791974
5-(aminomethyl)-N,3-dimethyl-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 80630342
5-bromo-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine
CID 63874581
5-chloro-2-N-methyl-2-N-(2-pyridin-4-ylethyl)pyridine-2,3-diamine
CID 80503008
3-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-4-carbonitrile
CID 80510544
4-N-cyclopropyl-2-N-methyl-2-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112882249

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine (CID 50951636) is 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine is Cc1nc(N(C)C)nc(N(C)CCc2ccncc2)c1C.
What is the InChIKey of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine?
The InChIKey is WDZZGCPSDDHQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-12-13(2)18-16(20(3)4)19-15(12)21(5)11-8-14-6-9-17-10-7-14/h6-7,9-10H,8,11H2,1-5H3.
What are the key properties of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine?
2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine has a molecular weight of 285.39 g/mol, XLogP of 2.23, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 50951636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).