1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine

C15H27N — CID 103903505

IUPAC1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine
SMILESCC1(CNC(C2CC2)C2CC2)CCCCC1
InChIInChI=1S/C15H27N/c1-15(9-3-2-4-10-15)11-16-14(12-5-6-12)13-7-8-13/h12-14,16H,2-11H2,1H3
InChIKeyPEEYUWXSTRWHAY-UHFFFAOYSA-N
MW221.39 g/mol
LogP3.73
Rot. Bonds5

About 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine

1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine (PubChem CID 103903505) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine.

Molecular Properties

Compound Name1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine
PubChem CID103903505
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine
SMILESCC1(CNC(C2CC2)C2CC2)CCCCC1
InChIInChI=1S/C15H27N/c1-15(9-3-2-4-10-15)11-16-14(12-5-6-12)13-7-8-13/h12-14,16H,2-11H2,1H3
InChIKeyPEEYUWXSTRWHAY-UHFFFAOYSA-N
XLogP3.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclohexanemethylamine, N-cyclopropyl-
CID 202172
4-tert-butyl-N-propan-2-ylcyclohexan-1-amine
CID 9120262
Cyclohexanemethylamine, N-cyclopropyl-alpha-methyl-
CID 202159
N,4,4-trimethylcyclohexan-1-amine
CID 550846
N-methylspiro[2.5]octan-6-amine
CID 68704589
N-cyclopropyl-4-methylcyclohexan-1-amine hydrochloride
CID 45286062
N-cyclopropyl-4-methylcyclohexan-1-amine
CID 16777707
N-[1-[1-[(3,3-difluorocyclohexyl)methyl]cyclopropyl]ethyl]propan-1-amine
CID 114224311
N-[2-(3,3-difluorocyclohexyl)-1-(1-methylcyclopropyl)ethyl]propan-1-amine
CID 114224895
N-[2-[(3,3-difluorocyclohexyl)methyl]-2-methylbutyl]cyclopropanamine
CID 114225117
N-[4-(3,3-difluorocyclohexyl)-3,3-dimethylbutyl]cyclopropanamine
CID 114225508
N-[(1-fluorocyclopropyl)methyl]-4,4-dimethylcyclohexan-1-amine
CID 126988189

Frequently Asked Questions

What is the IUPAC name of 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine?
The IUPAC name of 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine (CID 103903505) is 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine.
What is the SMILES notation for 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine?
The canonical SMILES for 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine is CC1(CNC(C2CC2)C2CC2)CCCCC1.
What is the InChIKey of 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine?
The InChIKey is PEEYUWXSTRWHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-15(9-3-2-4-10-15)11-16-14(12-5-6-12)13-7-8-13/h12-14,16H,2-11H2,1H3.
What are the key properties of 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine?
1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine has a molecular weight of 221.39 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dicyclopropyl-N-[(1-methylcyclohexyl)methyl]methanamine is sourced from PubChem (CID 103903505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).