4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine

C11H20N2 — CID 174318550

IUPAC4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine
SMILESCC1CCN(C2CC=C(N)CC2)C1
InChIInChI=1S/C11H20N2/c1-9-6-7-13(8-9)11-4-2-10(12)3-5-11/h2,9,11H,3-8,12H2,1H3
InChIKeyCPAKUMSOECAYHX-UHFFFAOYSA-N
MW180.30 g/mol
LogP1.72
Rot. Bonds1

About 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine

4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine (PubChem CID 174318550) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine.

Molecular Properties

Compound Name4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine
PubChem CID174318550
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC Name4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine
SMILESCC1CCN(C2CC=C(N)CC2)C1
InChIInChI=1S/C11H20N2/c1-9-6-7-13(8-9)11-4-2-10(12)3-5-11/h2,9,11H,3-8,12H2,1H3
InChIKeyCPAKUMSOECAYHX-UHFFFAOYSA-N
XLogP1.72
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-methylpyrrolidine;ethane
CID 176992470
1-cyclohexyl-3-methylpyrrolidine
CID 13402657
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CID 142381359
trans-(1R,2R)-2-(3-methylpyrrolidin-1-yl)cyclopentan-1-ol
CID 102734436
1-(4-methylcyclohex-3-en-1-yl)pyrrolidine
CID 130471845
N-methyl-3-[(3S)-3-methylpyrrolidin-1-yl]cyclopentan-1-amine
CID 164846620
(3R)-1-tert-butyl-3-[(3S)-3-methylpyrrolidin-1-yl]pyrrolidine
CID 166567380
ethane;4-(3-methylpyrrolidin-1-yl)-1-phenylcyclohexan-1-ol
CID 91168784
1-(4-fluorophenyl)-4-(3-methylpyrrolidin-1-yl)cyclohexan-1-ol
CID 20668518
1-methyl-3-(3-methylpiperidin-1-yl)piperidine
CID 66580299
4-methyl-3-(3-methylpyrrolidin-1-yl)cyclohexan-1-one
CID 165492170
1-(methylamino)-3-(3-methylpyrrolidin-1-yl)cyclopentane-1-carboxylic acid
CID 79654844

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine?
The IUPAC name of 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine (CID 174318550) is 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine.
What is the SMILES notation for 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine?
The canonical SMILES for 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine is CC1CCN(C2CC=C(N)CC2)C1.
What is the InChIKey of 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine?
The InChIKey is CPAKUMSOECAYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-9-6-7-13(8-9)11-4-2-10(12)3-5-11/h2,9,11H,3-8,12H2,1H3.
What are the key properties of 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine?
4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine has a molecular weight of 180.30 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylpyrrolidin-1-yl)cyclohexen-1-amine is sourced from PubChem (CID 174318550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).