N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine

C16H26N4 — CID 43675571

IUPACN-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine
SMILESCC1CCC(NC2CCN(c3ncccn3)CC2)CC1
InChIInChI=1S/C16H26N4/c1-13-3-5-14(6-4-13)19-15-7-11-20(12-8-15)16-17-9-2-10-18-16/h2,9-10,13-15,19H,3-8,11-12H2,1H3
InChIKeyMZVKCMWFLFRNRA-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.61
Rot. Bonds3

About N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine

N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine (PubChem CID 43675571) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine
PubChem CID43675571
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine
SMILESCC1CCC(NC2CCN(c3ncccn3)CC2)CC1
InChIInChI=1S/C16H26N4/c1-13-3-5-14(6-4-13)19-15-7-11-20(12-8-15)16-17-9-2-10-18-16/h2,9-10,13-15,19H,3-8,11-12H2,1H3
InChIKeyMZVKCMWFLFRNRA-UHFFFAOYSA-N
XLogP2.61
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-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

azane;2-(4-methylpiperidin-1-yl)pyrimidine
CID 70283358
N-(3-methoxycyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 106871636
N-propan-2-yl-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675626
N-methyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 114762763
N-butan-2-yl-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675609
N-cyclohexyl-1-pyrimidin-2-ylpiperidin-3-amine
CID 43728828
N-(1-cyclohexylethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 43779445
N-(1-pyrimidin-2-ylpiperidin-4-yl)pyridin-2-amine
CID 47054044
N-cyclopropyl-1-(2-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 79043433
N-ethyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 114762762
N-[(1R,2S)-2-[(E)-1-phenylprop-1-en-2-yl]cyclopropyl]-1-pyrimidin-2-ylpiperidin-4-amine
CID 122641169
N-[(1R,3S)-2,2-diethyl-3-methoxycyclobutyl]-1-pyrimidin-2-ylpiperidin-4-amine
CID 97336093

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The IUPAC name of N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine (CID 43675571) is N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The canonical SMILES for N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine is CC1CCC(NC2CCN(c3ncccn3)CC2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine?
The InChIKey is MZVKCMWFLFRNRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-13-3-5-14(6-4-13)19-15-7-11-20(12-8-15)16-17-9-2-10-18-16/h2,9-10,13-15,19H,3-8,11-12H2,1H3.
What are the key properties of N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine?
N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine has a molecular weight of 274.41 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-1-pyrimidin-2-ylpiperidin-4-amine is sourced from PubChem (CID 43675571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).