N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine

C18H36N2 — CID 79070623

IUPACN,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine
SMILESCCCNC(C1CCC(C)CC1)C1(N(C)C)CCCC1
InChIInChI=1S/C18H36N2/c1-5-14-19-17(16-10-8-15(2)9-11-16)18(20(3)4)12-6-7-13-18/h15-17,19H,5-14H2,1-4H3
InChIKeyZJBMMGZKWWJCAE-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.06
Rot. Bonds6

About N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine

N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine (PubChem CID 79070623) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine
PubChem CID79070623
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC NameN,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine
SMILESCCCNC(C1CCC(C)CC1)C1(N(C)C)CCCC1
InChIInChI=1S/C18H36N2/c1-5-14-19-17(16-10-8-15(2)9-11-16)18(20(3)4)12-6-7-13-18/h15-17,19H,5-14H2,1-4H3
InChIKeyZJBMMGZKWWJCAE-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[ethylamino-(4-methylcyclohexyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066377
1-[cyclopropyl(propylamino)methyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79074927
N,N-dimethyl-1-[oxan-4-yl(propylamino)methyl]cyclohexan-1-amine
CID 79066378
1-[(3-ethylcyclohexyl)-(propylamino)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79058669
1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79069853
N-[cyclopropyl-(1-methoxycyclopentyl)methyl]propan-1-amine
CID 104611352
N,N-diethyl-1-[hydrazinyl-(4-methylcyclohexyl)methyl]cyclopentan-1-amine
CID 105242683
N,N,4-trimethyl-1-[1-(propylamino)hex-4-ynyl]cyclohexan-1-amine
CID 104806557
N,N,4-trimethyl-1-[2-propoxy-1-(propylamino)ethyl]cyclohexan-1-amine
CID 79569527
1-[2-methoxy-1-(propylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79570649
N,N-diethyl-1-[oxan-3-yl(propylamino)methyl]cyclopentan-1-amine
CID 107136596
1-[cycloheptyl(hydrazinyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 105243452

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine (CID 79070623) is N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine is CCCNC(C1CCC(C)CC1)C1(N(C)C)CCCC1.
What is the InChIKey of N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine?
The InChIKey is ZJBMMGZKWWJCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-5-14-19-17(16-10-8-15(2)9-11-16)18(20(3)4)12-6-7-13-18/h15-17,19H,5-14H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine?
N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine has a molecular weight of 280.50 g/mol, XLogP of 4.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine is sourced from PubChem (CID 79070623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).