6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

C16H25ClN4 — CID 82463101

IUPAC6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
SMILESCC1(C)CC(Nc2cc(Cl)nc(C3CC3)n2)CC(C)(C)N1
InChIInChI=1S/C16H25ClN4/c1-15(2)8-11(9-16(3,4)21-15)18-13-7-12(17)19-14(20-13)10-5-6-10/h7,10-11,21H,5-6,8-9H2,1-4H3,(H,18,19,20)
InChIKeyXJPLPVZFJUKRJC-UHFFFAOYSA-N
MW308.86 g/mol
LogP3.73
Rot. Bonds3

About 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine (PubChem CID 82463101) has the molecular formula C16H25ClN4 and a molecular weight of 308.86 g/mol. Its IUPAC name is 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
PubChem CID82463101
Molecular FormulaC16H25ClN4
Molecular Weight308.86 g/mol
Exact Mass308.18
IUPAC Name6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
SMILESCC1(C)CC(Nc2cc(Cl)nc(C3CC3)n2)CC(C)(C)N1
InChIInChI=1S/C16H25ClN4/c1-15(2)8-11(9-16(3,4)21-15)18-13-7-12(17)19-14(20-13)10-5-6-10/h7,10-11,21H,5-6,8-9H2,1-4H3,(H,18,19,20)
InChIKeyXJPLPVZFJUKRJC-UHFFFAOYSA-N
XLogP3.73
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.86
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-6-methoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
CID 82456357
6-chloro-2-cyclopropyl-N-(3,5-dimethylcyclohexyl)pyrimidin-4-amine
CID 80951663
6-chloro-2-cyclopropyl-N-(3-methylsulfanylcyclopentyl)pyrimidin-4-amine
CID 103880252
2-chloro-6-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
CID 82460532
6-chloro-2-cyclopropyl-N-[4-[(dimethylamino)methyl]cyclohexyl]pyrimidin-4-amine
CID 133421904
6-chloro-2-cyclopropyl-N-(1-methylcyclobutyl)pyrimidin-4-amine
CID 115875734
6-chloro-2-cyclopropyl-N-(1-oxaspiro[5.5]undecan-4-yl)pyrimidin-4-amine
CID 133421176
1-[4-[(6-chloro-2-cyclopropylpyrimidin-4-yl)amino]piperidin-1-yl]-2-methylpropan-1-one
CID 133418296
(E)-but-2-enedioic acid;5-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridin-2-amine
CID 159577215
6-chloro-2-cyclopropyl-N-(2-propylcyclopropyl)pyrimidin-4-amine
CID 103880293
ethyl 3-[(6-chloro-2-cyclopropylpyrimidin-4-yl)amino]cyclopentane-1-carboxylate
CID 133420616
3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 39339122

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The IUPAC name of 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine (CID 82463101) is 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine is CC1(C)CC(Nc2cc(Cl)nc(C3CC3)n2)CC(C)(C)N1.
What is the InChIKey of 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The InChIKey is XJPLPVZFJUKRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN4/c1-15(2)8-11(9-16(3,4)21-15)18-13-7-12(17)19-14(20-13)10-5-6-10/h7,10-11,21H,5-6,8-9H2,1-4H3,(H,18,19,20).
What are the key properties of 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine has a molecular weight of 308.86 g/mol, XLogP of 3.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclopropyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 82463101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).