1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine

C15H29N3 — CID 123171555

IUPAC1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCCC(CNC3CC3)C2)C1
InChIInChI=1S/C15H29N3/c1-16-14-7-8-18(11-14)15-4-2-3-12(9-15)10-17-13-5-6-13/h12-17H,2-11H2,1H3
InChIKeyDBVFDPUIOUGDHE-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.59
Rot. Bonds5

About 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine

1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine (PubChem CID 123171555) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine
PubChem CID123171555
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCCC(CNC3CC3)C2)C1
InChIInChI=1S/C15H29N3/c1-16-14-7-8-18(11-14)15-4-2-3-12(9-15)10-17-13-5-6-13/h12-17H,2-11H2,1H3
InChIKeyDBVFDPUIOUGDHE-UHFFFAOYSA-N
XLogP1.59
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(3-ethylcyclohexyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 64741079
N-cyclopropyl-1-(3-ethylcyclohexyl)pyrrolidin-3-amine
CID 64748391
1-cycloheptyl-N-methylpyrrolidin-3-amine
CID 43315596
N-(cyclopropylmethyl)-1-(3-propan-2-ylcyclohexyl)piperidin-4-amine
CID 107449560
N-[[1-(3-methylcyclopentyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 114546859
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328
N-(cyclopropylmethyl)-1-(4-propylcycloheptyl)piperidin-4-amine
CID 115306940
ethane;N-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-6-amine
CID 170747754
N-(cyclopentylmethyl)-1-(3-methylcyclobutyl)piperidin-3-amine
CID 83998037
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethylcyclohexan-1-amine
CID 54920980
3-(4-ethylazepan-1-yl)-N-methylcyclohexan-1-amine
CID 79618405
N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
CID 83907747

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine?
The IUPAC name of 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine (CID 123171555) is 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine?
The canonical SMILES for 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine is CNC1CCN(C2CCCC(CNC3CC3)C2)C1.
What is the InChIKey of 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine?
The InChIKey is DBVFDPUIOUGDHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-16-14-7-8-18(11-14)15-4-2-3-12(9-15)10-17-13-5-6-13/h12-17H,2-11H2,1H3.
What are the key properties of 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine?
1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine has a molecular weight of 251.42 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(cyclopropylamino)methyl]cyclohexyl]-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 123171555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).