1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine

C19H38N2 — CID 79059409

IUPAC1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCN(CC)C1(C(NC)C2CC(C)CC(C)C2)CCCC1
InChIInChI=1S/C19H38N2/c1-6-21(7-2)19(10-8-9-11-19)18(20-5)17-13-15(3)12-16(4)14-17/h15-18,20H,6-14H2,1-5H3
InChIKeyGDPFSENPHYOQQB-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.30
Rot. Bonds6

About 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine

1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine (PubChem CID 79059409) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine
PubChem CID79059409
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCN(CC)C1(C(NC)C2CC(C)CC(C)C2)CCCC1
InChIInChI=1S/C19H38N2/c1-6-21(7-2)19(10-8-9-11-19)18(20-5)17-13-15(3)12-16(4)14-17/h15-18,20H,6-14H2,1-5H3
InChIKeyGDPFSENPHYOQQB-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(diethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanol
CID 79069865
N,N-diethyl-1-[hydrazinyl-(4-methylcyclohexyl)methyl]cyclopentan-1-amine
CID 105242683
N,N-diethyl-1-[3-ethyl-1-(methylamino)pentyl]cyclopentan-1-amine
CID 82922642
N,N-diethyl-1-[hydrazinyl(oxolan-3-yl)methyl]cyclopentan-1-amine
CID 105242602
1-[(3,4-dimethylcyclohexyl)-(methylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 79064554
N,N-diethyl-1-[3-methyl-1-(methylamino)pentyl]cyclopentan-1-amine
CID 79070265
1-(3,5-dimethylcyclohexyl)-1-(1-methoxy-4,4-dimethylcyclohexyl)-N-methylmethanamine
CID 116769246
1-[amino-(3,5-dimethylcyclohexyl)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79070124
N,N-diethyl-1-[hydrazinyl(oxan-3-yl)methyl]cyclopentan-1-amine
CID 107139613
1-[1-(diethylamino)cyclopentyl]ethanol
CID 79070716
N,N-diethyl-1-[oxan-3-yl(propylamino)methyl]cyclopentan-1-amine
CID 107136596
N,N-diethyl-1-[1-(ethylamino)-2-propan-2-yloxyethyl]cyclopentan-1-amine
CID 79569953

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine (CID 79059409) is 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine is CCN(CC)C1(C(NC)C2CC(C)CC(C)C2)CCCC1.
What is the InChIKey of 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The InChIKey is GDPFSENPHYOQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-6-21(7-2)19(10-8-9-11-19)18(20-5)17-13-15(3)12-16(4)14-17/h15-18,20H,6-14H2,1-5H3.
What are the key properties of 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine?
1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethylcyclohexyl)-(methylamino)methyl]-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 79059409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).