N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine

C19H27N5 — CID 166889012

IUPACN-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cnc(NC2CCC(Cc3ccc(N)nc3)CC2)nc1
InChIInChI=1S/C19H27N5/c1-13(2)16-11-22-19(23-12-16)24-17-6-3-14(4-7-17)9-15-5-8-18(20)21-10-15/h5,8,10-14,17H,3-4,6-7,9H2,1-2H3,(H2,20,21)(H,22,23,24)
InChIKeyMTIOIVUKOXDREN-UHFFFAOYSA-N
MW325.46 g/mol
LogP3.79
Rot. Bonds5

About N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine

N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine (PubChem CID 166889012) has the molecular formula C19H27N5 and a molecular weight of 325.46 g/mol. Its IUPAC name is N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine
PubChem CID166889012
Molecular FormulaC19H27N5
Molecular Weight325.46 g/mol
Exact Mass325.23
IUPAC NameN-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cnc(NC2CCC(Cc3ccc(N)nc3)CC2)nc1
InChIInChI=1S/C19H27N5/c1-13(2)16-11-22-19(23-12-16)24-17-6-3-14(4-7-17)9-15-5-8-18(20)21-10-15/h5,8,10-14,17H,3-4,6-7,9H2,1-2H3,(H2,20,21)(H,22,23,24)
InChIKeyMTIOIVUKOXDREN-UHFFFAOYSA-N
XLogP3.79
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N-methyl-4-N-(5-propan-2-ylpyrimidin-2-yl)cyclohexane-1,4-diamine
CID 116974960
5-[3-(cyclobutylamino)butyl]pyridin-2-amine
CID 69324744
2-N-(4-propylcyclohexyl)pyrimidine-2,5-diamine
CID 54962936
2-N-cyclopropylpyrimidine-2,5-diamine
CID 59381911
(3aR,6aS)-2-[[4-[4-[(5-propan-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]phenyl]methyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 178026071
5-[[(1R,3S)-3-[(S)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]cyclopentyl]methyl]pyridin-2-amine
CID 158028190
5-[[(3S)-3-[(S)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]cyclopentyl]methyl]pyridin-2-amine
CID 158028191
5-[(4-propan-2-ylpiperidin-1-yl)methyl]pyridin-2-amine
CID 104870271
5-(1-amino-2-cyclopropylethyl)pyridin-2-amine
CID 55294489
5-[1-(cyclohexylmethylamino)ethyl]pyridin-2-amine
CID 155167486
4-N-(5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine
CID 63208372
5-[3-(2-methylpropylamino)butyl]pyridin-2-amine
CID 69324274

Frequently Asked Questions

What is the IUPAC name of N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine?
The IUPAC name of N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine (CID 166889012) is N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine is CC(C)c1cnc(NC2CCC(Cc3ccc(N)nc3)CC2)nc1.
What is the InChIKey of N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine?
The InChIKey is MTIOIVUKOXDREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5/c1-13(2)16-11-22-19(23-12-16)24-17-6-3-14(4-7-17)9-15-5-8-18(20)21-10-15/h5,8,10-14,17H,3-4,6-7,9H2,1-2H3,(H2,20,21)(H,22,23,24).
What are the key properties of N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine?
N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine has a molecular weight of 325.46 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(6-amino-3-pyridinyl)methyl]cyclohexyl]-5-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 166889012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).