[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine

C15H32N4 — CID 28745310

IUPAC[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
SMILESCC(C)N1CCC(CN)(N2CCCN(C)CC2)CC1
InChIInChI=1S/C15H32N4/c1-14(2)18-9-5-15(13-16,6-10-18)19-8-4-7-17(3)11-12-19/h14H,4-13,16H2,1-3H3
InChIKeyLFLSDYZAEXDERC-UHFFFAOYSA-N
MW268.45 g/mol
LogP0.83
Rot. Bonds3

About [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine

[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine (PubChem CID 28745310) has the molecular formula C15H32N4 and a molecular weight of 268.45 g/mol. Its IUPAC name is [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine.

Molecular Properties

Compound Name[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
PubChem CID28745310
Molecular FormulaC15H32N4
Molecular Weight268.45 g/mol
Exact Mass268.26
IUPAC Name[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
SMILESCC(C)N1CCC(CN)(N2CCCN(C)CC2)CC1
InChIInChI=1S/C15H32N4/c1-14(2)18-9-5-15(13-16,6-10-18)19-8-4-7-17(3)11-12-19/h14H,4-13,16H2,1-3H3
InChIKeyLFLSDYZAEXDERC-UHFFFAOYSA-N
XLogP0.83
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.45
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine 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-methyl-4-(4-methylpiperazin-1-yl)azepan-4-yl]methanamine
CID 65075564
[1-methyl-3-(4-propan-2-ylpiperazin-1-yl)pyrrolidin-3-yl]methanamine
CID 62977681
[4-(4-methyl-1,4-diazepan-1-yl)oxan-4-yl]methanamine
CID 43608698
[4-(4,4-dimethylazepan-1-yl)-1-propan-2-ylazepan-4-yl]methanamine
CID 65283742
[1-(4-methyl-1,4-diazepan-1-yl)-4-propan-2-ylcycloheptyl]methanamine
CID 65091393
[4-(4-methylsulfonylpiperazin-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
CID 62993592
[3-methyl-1-(4-methyl-1,4-diazepan-1-yl)cyclohexyl]methanamine
CID 43209340
[1-methyl-4-(4-propan-2-ylpiperidin-1-yl)azepan-4-yl]methanamine
CID 103494627
1-[4-(aminomethyl)-1-propan-2-ylazepan-4-yl]-N,N-dimethylpiperidin-4-amine
CID 65078068
[4-(7,7-dimethyl-1,4-thiazepan-4-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
CID 107454254
[3-(3-azaspiro[5.5]undecan-3-yl)-1-propan-2-ylpyrrolidin-3-yl]methanamine
CID 62937205
[3,3-dimethyl-1-(4-propan-2-ylpiperazin-1-yl)cyclopentyl]methanamine
CID 80706349

Frequently Asked Questions

What is the IUPAC name of [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine?
The IUPAC name of [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine (CID 28745310) is [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine.
What is the SMILES notation for [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine?
The canonical SMILES for [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine is CC(C)N1CCC(CN)(N2CCCN(C)CC2)CC1.
What is the InChIKey of [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine?
The InChIKey is LFLSDYZAEXDERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4/c1-14(2)18-9-5-15(13-16,6-10-18)19-8-4-7-17(3)11-12-19/h14H,4-13,16H2,1-3H3.
What are the key properties of [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine?
[4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine has a molecular weight of 268.45 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methyl-1,4-diazepan-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine is sourced from PubChem (CID 28745310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).