N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine

C12H23N — CID 61223759

IUPACN-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine
SMILESCC1(C)CC1NCC1CCCCC1
InChIInChI=1S/C12H23N/c1-12(2)8-11(12)13-9-10-6-4-3-5-7-10/h10-11,13H,3-9H2,1-2H3
InChIKeySNYJPKQUXLGXCH-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds3

About N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine

N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine (PubChem CID 61223759) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine
PubChem CID61223759
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC NameN-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine
SMILESCC1(C)CC1NCC1CCCCC1
InChIInChI=1S/C12H23N/c1-12(2)8-11(12)13-9-10-6-4-3-5-7-10/h10-11,13H,3-9H2,1-2H3
InChIKeySNYJPKQUXLGXCH-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclooctylmethyl)-2,2-dimethylcyclopentan-1-amine
CID 114207760
N-(cycloheptylmethyl)-2,2-dimethylcyclohexan-1-amine
CID 79860846
N-(cyclooctylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
CID 114207759
N-(cyclohexylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 43182326
N-(cyclobutylmethyl)cycloheptanamine
CID 43298514
2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine
CID 130871447
N-(cyclopentylmethyl)-2,4,4-trimethylcyclohexan-1-amine
CID 81321267
3-[3-(cyclohexylmethylamino)-6-hydroxy-1,1,6-trimethyl-2,3,4,5,7,7a-hexahydroinden-3a-yl]-N-cyclopropylpropanamide
CID 74443529
N-(cyclopentylmethyl)-4,4-dimethylcycloheptan-1-amine
CID 65084515
N-(cyclohexylmethyl)-1-(1-methylcyclopropyl)ethanamine
CID 43371383
2,2-dimethyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 80554356
2,2-dimethyl-N-(oxan-3-ylmethyl)cyclohexan-1-amine
CID 79834755

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine?
The IUPAC name of N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine (CID 61223759) is N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine?
The canonical SMILES for N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine is CC1(C)CC1NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine?
The InChIKey is SNYJPKQUXLGXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-12(2)8-11(12)13-9-10-6-4-3-5-7-10/h10-11,13H,3-9H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine?
N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine has a molecular weight of 181.32 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2,2-dimethylcyclopropan-1-amine is sourced from PubChem (CID 61223759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).