1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine

C15H26N2 — CID 123878687

IUPAC1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine
SMILESCC(CC1CCCCC1)NCC1=CN=CCC1
InChIInChI=1S/C15H26N2/c1-13(10-14-6-3-2-4-7-14)17-12-15-8-5-9-16-11-15/h9,11,13-14,17H,2-8,10,12H2,1H3
InChIKeyBIRRUDOTVJECDS-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.68
Rot. Bonds5

About 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine

1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine (PubChem CID 123878687) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine
PubChem CID123878687
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine
SMILESCC(CC1CCCCC1)NCC1=CN=CCC1
InChIInChI=1S/C15H26N2/c1-13(10-14-6-3-2-4-7-14)17-12-15-8-5-9-16-11-15/h9,11,13-14,17H,2-8,10,12H2,1H3
InChIKeyBIRRUDOTVJECDS-UHFFFAOYSA-N
XLogP3.68
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-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

2-Methyl-5-piperidin-4-yl-3,4-dihydropyridine
CID 91019224
2-(1,2,3,4-Tetrahydropyridin-5-yl)-2,3,4,5-tetrahydropyridine
CID 91440913
1-cyclohexyl-N-(2,5-dihydropyridin-4-ylmethyl)propan-2-amine
CID 123222540
1-cyclohexyl-N-(2,5-dihydropyridin-3-ylmethyl)propan-2-amine
CID 123362170
1-(4-ethanimidoyl-4-methyl-3H-pyridin-5-yl)-N-methylpropan-1-amine
CID 123595616
N-ethyl-5-methyl-7-[(methylideneamino)methylidene]decan-2-amine
CID 123938507
4-(3,4-Dihydropyridin-5-yl)pentan-1-amine
CID 124029169
(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine
CID 139539344
1-(3,4-dihydropyridin-5-yl)-N-methylpropan-1-amine
CID 142884393
(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole
CID 147410620
4-[(Z)-1-amino-3-methyliminoprop-1-en-2-yl]cyclohexan-1-amine;molecular hydrogen
CID 153404772
1-(3,4-dihydropyridin-3-yl)-N-methylpentan-1-amine
CID 163825885

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine?
The IUPAC name of 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine (CID 123878687) is 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine?
The canonical SMILES for 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine is CC(CC1CCCCC1)NCC1=CN=CCC1.
What is the InChIKey of 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine?
The InChIKey is BIRRUDOTVJECDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-13(10-14-6-3-2-4-7-14)17-12-15-8-5-9-16-11-15/h9,11,13-14,17H,2-8,10,12H2,1H3.
What are the key properties of 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine?
1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine has a molecular weight of 234.39 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(3,4-dihydropyridin-5-ylmethyl)propan-2-amine is sourced from PubChem (CID 123878687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).