N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine

C13H25N — CID 115892730

IUPACN-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine
SMILESCCC1(CNC2CCCCC2C)CC1
InChIInChI=1S/C13H25N/c1-3-13(8-9-13)10-14-12-7-5-4-6-11(12)2/h11-12,14H,3-10H2,1-2H3
InChIKeyIFVSYVFTOGAGEK-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds4

About N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine

N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine (PubChem CID 115892730) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine
PubChem CID115892730
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine
SMILESCCC1(CNC2CCCCC2C)CC1
InChIInChI=1S/C13H25N/c1-3-13(8-9-13)10-14-12-7-5-4-6-11(12)2/h11-12,14H,3-10H2,1-2H3
InChIKeyIFVSYVFTOGAGEK-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-[[(2-methylcyclohexyl)amino]methyl]cyclopropyl]acetonitrile
CID 65480154
trans-(1S,2S)-2-methyl-N-[[3-[[[(1S,2R)-2-methylcyclohexyl]amino]methyl]oxetan-3-yl]methyl]cyclohexan-1-amine
CID 124732476
N-[(1-ethylcyclopropyl)methyl]-2-methylthiolan-3-amine
CID 102672499
N-ethyl-2-methylcyclohexan-1-amine;hydrochloride
CID 50988234
1-[[[(1S,2S)-2-methylcyclopentyl]amino]methyl]cyclohexan-1-ol
CID 95377558
2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]cyclopentan-1-amine
CID 107267414
trans-(1R,2R)-N-ethyl-2-methylcyclopentan-1-amine
CID 71351363
2-methyl-3-[[(2-methylcyclohexyl)amino]methyl]oxolan-3-ol
CID 107270894
2-[1-[[(2,3-dimethylcyclohexyl)amino]methyl]cyclopropyl]acetonitrile
CID 65480950
N-[(1-ethylcyclopentyl)methyl]-2-methylsulfonylcyclopentan-1-amine
CID 113350840
N-[(1-ethylcyclopropyl)methyl]-3-methylcyclohexan-1-amine;hydrochloride
CID 115680355
4-hydroxy-4-[[(2-methylcycloheptyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 106499521

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine?
The IUPAC name of N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine (CID 115892730) is N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine.
What is the SMILES notation for N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine?
The canonical SMILES for N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine is CCC1(CNC2CCCCC2C)CC1.
What is the InChIKey of N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine?
The InChIKey is IFVSYVFTOGAGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-3-13(8-9-13)10-14-12-7-5-4-6-11(12)2/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine?
N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopropyl)methyl]-2-methylcyclohexan-1-amine is sourced from PubChem (CID 115892730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).