N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine

C13H25N — CID 43371383

IUPACN-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine
SMILESCC(NCC1CCCCC1)C1(C)CC1
InChIInChI=1S/C13H25N/c1-11(13(2)8-9-13)14-10-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3
InChIKeyWMSCMDQHTTXNGG-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds4

About N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine

N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine (PubChem CID 43371383) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine
PubChem CID43371383
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine
SMILESCC(NCC1CCCCC1)C1(C)CC1
InChIInChI=1S/C13H25N/c1-11(13(2)8-9-13)14-10-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3
InChIKeyWMSCMDQHTTXNGG-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

N-(cyclopentylmethyl)-1-(1-methylcyclopropyl)ethanamine
CID 43370725
1-(1-methylcyclopropyl)-N-(oxan-3-ylmethyl)ethanamine
CID 61020377
N-[(1,1-dioxothian-4-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
CID 115896671
N-(2-cyclobutylethyl)-1-(1-methylcyclopropyl)ethanamine
CID 115893413
(1S)-N-(cyclobutylmethyl)-1-cycloheptylethanamine
CID 81390333
(1R)-N-(cyclobutylmethyl)-1-cycloheptylethanamine
CID 81391954
(1R)-N-(cyclobutylmethyl)-1-cyclohexylethanamine
CID 81385089
N'-cyclopentyl-N'-methyl-N-[1-(1-methylcyclopropyl)ethyl]ethane-1,2-diamine
CID 63314802
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
CID 63898738
2-methyl-N-[1-(1-methylcyclopropyl)ethyl]propan-1-amine
CID 43173428
(1R)-N-(cyclobutylmethyl)-1-cyclopentylethanamine
CID 81393857
N-(cyclopentylmethyl)-2,6-dimethylheptan-4-amine
CID 43370762

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine?
The IUPAC name of N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine (CID 43371383) is N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine.
What is the SMILES notation for N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine?
The canonical SMILES for N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine is CC(NCC1CCCCC1)C1(C)CC1.
What is the InChIKey of N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine?
The InChIKey is WMSCMDQHTTXNGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-11(13(2)8-9-13)14-10-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine?
N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine 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-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine is sourced from PubChem (CID 43371383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).