4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine

C13H26N2 — CID 60850888

IUPAC4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine
SMILESCCCN(CC1CCC(N)CC1)C1CC1
InChIInChI=1S/C13H26N2/c1-2-9-15(13-7-8-13)10-11-3-5-12(14)6-4-11/h11-13H,2-10,14H2,1H3
InChIKeyBHLQDPSMJKDHDH-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.38
Rot. Bonds5

About 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine

4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine (PubChem CID 60850888) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine
PubChem CID60850888
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine
SMILESCCCN(CC1CCC(N)CC1)C1CC1
InChIInChI=1S/C13H26N2/c1-2-9-15(13-7-8-13)10-11-3-5-12(14)6-4-11/h11-13H,2-10,14H2,1H3
InChIKeyBHLQDPSMJKDHDH-UHFFFAOYSA-N
XLogP2.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-Ethylhexyl)cyclohexanamine
CID 221524
Cyclohexanemethylamine, N-cyclopropyl-
CID 202172
N,4-Dimethylcyclohexanamine
CID 4962029
Cyclohexanemethylamine, N-cyclopropyl-alpha-methyl-
CID 202159
Cyclohexanemethylamine, N-cyclopropyl-N-methyl-
CID 202160
2-[(Diethylamino)methyl]cyclohexan-1-amine
CID 23009041
2-[(Dimethylamino)methyl]cyclohexan-1-amine
CID 23009040
N-(4-Methylheptan-2-yl)cyclopropanamine
CID 27732
rac-(1r,4r)-4-(aminomethyl)-N,N-dimethylcyclohexan-1-amine
CID 23293344
1-(4-Methylcyclohexyl)piperidin-4-amine
CID 24699417
N1,N1,1-trimethylcyclohexane-1,4-diamine
CID 125511609
Cambridge id 5418134
CID 782244

Frequently Asked Questions

What is the IUPAC name of 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine (CID 60850888) is 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine is CCCN(CC1CCC(N)CC1)C1CC1.
What is the InChIKey of 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is BHLQDPSMJKDHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-9-15(13-7-8-13)10-11-3-5-12(14)6-4-11/h11-13H,2-10,14H2,1H3.
What are the key properties of 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine?
4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[cyclopropyl(propyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 60850888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).