3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine

C16H31N3 — CID 62977319

IUPAC3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
SMILESCC1CCC(N(C)C2(CN)CCN(C3CC3)C2)CC1
InChIInChI=1S/C16H31N3/c1-13-3-5-14(6-4-13)18(2)16(11-17)9-10-19(12-16)15-7-8-15/h13-15H,3-12,17H2,1-2H3
InChIKeyKPISVPSLHNIUNN-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.06
Rot. Bonds4

About 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine

3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine (PubChem CID 62977319) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
PubChem CID62977319
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
SMILESCC1CCC(N(C)C2(CN)CCN(C3CC3)C2)CC1
InChIInChI=1S/C16H31N3/c1-13-3-5-14(6-4-13)18(2)16(11-17)9-10-19(12-16)15-7-8-15/h13-15H,3-12,17H2,1-2H3
InChIKeyKPISVPSLHNIUNN-UHFFFAOYSA-N
XLogP2.06
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(aminomethyl)-1-cyclopropylpyrrolidin-3-yl]-N,1-dimethylpiperidin-3-amine
CID 62976020
3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine
CID 62975820
3-(aminomethyl)-N-butyl-1-cyclopropyl-N-ethylpyrrolidin-3-amine
CID 62975638
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)pyrrolidin-3-amine
CID 62977877
4-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)-1-propylazepan-4-amine
CID 65078813
3-(aminomethyl)-N,1,5-trimethyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
CID 81467887
4-(aminomethyl)-N-cyclopropyl-1-ethyl-N-methylpiperidin-4-amine
CID 43264813
3-(aminomethyl)-N-cycloheptyl-N,1-dimethylpyrrolidin-3-amine
CID 62975279
3-(aminomethyl)-N-butan-2-yl-N-butyl-1-cyclopropylpyrrolidin-3-amine
CID 55141796
1-(aminomethyl)-N-cyclohexyl-N,4-dimethylcyclohexan-1-amine
CID 43409627
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine
CID 62976010
3-(aminomethyl)-1-cyclopropyl-N-ethyl-N-(1-methoxypropan-2-yl)pyrrolidin-3-amine
CID 62976391

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine?
The IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine (CID 62977319) is 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine.
What is the SMILES notation for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine?
The canonical SMILES for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine is CC1CCC(N(C)C2(CN)CCN(C3CC3)C2)CC1.
What is the InChIKey of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine?
The InChIKey is KPISVPSLHNIUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-13-3-5-14(6-4-13)18(2)16(11-17)9-10-19(12-16)15-7-8-15/h13-15H,3-12,17H2,1-2H3.
What are the key properties of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine?
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine has a molecular weight of 265.44 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine is sourced from PubChem (CID 62977319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).