N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide

C14H26N2O — CID 119610883

IUPACN-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide
SMILESCCC1(C)CC1C(=O)NC1CCCCC1CN
InChIInChI=1S/C14H26N2O/c1-3-14(2)8-11(14)13(17)16-12-7-5-4-6-10(12)9-15/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyHQAHKZQBPNVKPI-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.06
Rot. Bonds4

About N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide

N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide (PubChem CID 119610883) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide
PubChem CID119610883
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide
SMILESCCC1(C)CC1C(=O)NC1CCCCC1CN
InChIInChI=1S/C14H26N2O/c1-3-14(2)8-11(14)13(17)16-12-7-5-4-6-10(12)9-15/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyHQAHKZQBPNVKPI-UHFFFAOYSA-N
XLogP2.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-1-ethylsulfonylpiperidine-4-carboxamide;hydrochloride
CID 119612379
[(1S,2R)-2-(aminomethyl)cyclohexyl]carbamic acid
CID 124566826
[(1R,2S)-2-(aminomethyl)cyclohexyl]carbamic acid
CID 124566827
[(1S,2R)-2-(aminomethyl)cyclopentyl]urea
CID 94903973
N-[2-(aminomethyl)cyclopentyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxamide
CID 119602905
N-[2-(aminomethyl)cyclohexyl]thiane-4-carboxamide
CID 119612086
N-[2-(aminomethyl)cyclohexyl]-2-methylbutanamide;hydrochloride
CID 119609146
N-[1-(aminomethyl)cyclopentyl]-2-ethyl-2-methylcyclopropane-1-carboxamide
CID 119566673
1-[2-(aminomethyl)cyclohexyl]-3-cyclobutylurea
CID 116658641
N-[2-(aminomethyl)cyclohexyl]-3-methylsulfanylpropanamide;hydrochloride
CID 119611809
N-[2-(aminomethyl)cyclopentyl]pentanamide
CID 62957090
N-[2-(aminomethyl)cyclopentyl]pyrrolidine-1-carboxamide
CID 79162307

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide (CID 119610883) is N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide is CCC1(C)CC1C(=O)NC1CCCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide?
The InChIKey is HQAHKZQBPNVKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-14(2)8-11(14)13(17)16-12-7-5-4-6-10(12)9-15/h10-12H,3-9,15H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide?
N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-2-ethyl-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 119610883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).