N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide

C12H22N2O — CID 64928230

IUPACN-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCC1CCCCC1N
InChIInChI=1S/C12H22N2O/c1-8-6-10(8)12(15)14-7-9-4-2-3-5-11(9)13/h8-11H,2-7,13H2,1H3,(H,14,15)
InChIKeyIVJIJNUBHXZVBP-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.28
Rot. Bonds3

About N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide

N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide (PubChem CID 64928230) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide
PubChem CID64928230
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCC1CCCCC1N
InChIInChI=1S/C12H22N2O/c1-8-6-10(8)12(15)14-7-9-4-2-3-5-11(9)13/h8-11H,2-7,13H2,1H3,(H,14,15)
InChIKeyIVJIJNUBHXZVBP-UHFFFAOYSA-N
XLogP1.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-aminocyclohexyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 64928421
4-amino-2-methyl-N-[(2-methylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 55116865
N-[(2-aminocyclopentyl)methyl]-3-methyloxane-4-carboxamide
CID 114241768
4-amino-N-[(2-methylcyclohexyl)methyl]oxolane-3-carboxamide
CID 66237085
N-[(2-aminocyclopentyl)methyl]-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 115737026
2-[(2-methylcyclopentyl)methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 107416685
1-[(2-aminocyclohexyl)methyl]-3-ethylurea
CID 64927851
N-[[2-(bromomethyl)cyclohexyl]methyl]-2-methylcyclopentane-1-carboxamide
CID 107184223
2-amino-N-[(4-methylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 63247870
N-[(2-aminocyclopentyl)methyl]tricyclo[3.2.1.02,4]octane-3-carboxamide
CID 103806310
(2-methylcyclopentyl)methylurea
CID 107417745
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133

Frequently Asked Questions

What is the IUPAC name of N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide (CID 64928230) is N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NCC1CCCCC1N.
What is the InChIKey of N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide?
The InChIKey is IVJIJNUBHXZVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-8-6-10(8)12(15)14-7-9-4-2-3-5-11(9)13/h8-11H,2-7,13H2,1H3,(H,14,15).
What are the key properties of N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide?
N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-aminocyclohexyl)methyl]-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 64928230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).