N-methylcyclohexen-1-amine

C7H13N — CID 18621675

IUPACN-methylcyclohexen-1-amine
SMILESCNC1=CCCCC1
InChIInChI=1S/C7H13N/c1-8-7-5-3-2-4-6-7/h5,8H,2-4,6H2,1H3
InChIKeyQZANVRBPERFYER-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.66
Rot. Bonds1

About N-methylcyclohexen-1-amine

N-methylcyclohexen-1-amine (PubChem CID 18621675) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is N-methylcyclohexen-1-amine.

Molecular Properties

Compound NameN-methylcyclohexen-1-amine
PubChem CID18621675
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC NameN-methylcyclohexen-1-amine
SMILESCNC1=CCCCC1
InChIInChI=1S/C7H13N/c1-8-7-5-3-2-4-6-7/h5,8H,2-4,6H2,1H3
InChIKeyQZANVRBPERFYER-UHFFFAOYSA-N
XLogP1.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-Methyltetrahydropyridine
CID 12231236
5-fluoro-N,3-dimethylcyclohexen-1-amine
CID 170185936
4,4-difluoro-N-methylcyclohexen-1-amine
CID 162565161
6-Ethyl-1,2,3,4-tetrahydropyridine
CID 12231237
N-ethylcyclopenten-1-amine
CID 18314195
N-propylcyclohepten-1-amine
CID 18779978
2-N-methylcyclohexene-1,2-diamine
CID 19049144
N-methylcyclohexa-1,3-dien-1-amine
CID 19382575
(Z)-N-methylpent-2-en-3-amine
CID 20603015
N-Ethylcyclohex-1-en-1-amine
CID 21115464
5-butyl-2,3-dihydro-1H-pyrrole
CID 21477759
N-methylcyclopenten-1-amine
CID 21487314

Frequently Asked Questions

What is the IUPAC name of N-methylcyclohexen-1-amine?
The IUPAC name of N-methylcyclohexen-1-amine (CID 18621675) is N-methylcyclohexen-1-amine.
What is the SMILES notation for N-methylcyclohexen-1-amine?
The canonical SMILES for N-methylcyclohexen-1-amine is CNC1=CCCCC1.
What is the InChIKey of N-methylcyclohexen-1-amine?
The InChIKey is QZANVRBPERFYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-8-7-5-3-2-4-6-7/h5,8H,2-4,6H2,1H3.
What are the key properties of N-methylcyclohexen-1-amine?
N-methylcyclohexen-1-amine has a molecular weight of 111.19 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylcyclohexen-1-amine is sourced from PubChem (CID 18621675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).