1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine

C13H28N2 — CID 79066659

IUPAC1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine
SMILESCCCCC(N)C1(N(C)C)CCCCC1
InChIInChI=1S/C13H28N2/c1-4-5-9-12(14)13(15(2)3)10-7-6-8-11-13/h12H,4-11,14H2,1-3H3
InChIKeyMBONJWSRXVWYBA-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.77
Rot. Bonds5

About 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine

1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine (PubChem CID 79066659) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine
PubChem CID79066659
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine
SMILESCCCCC(N)C1(N(C)C)CCCCC1
InChIInChI=1S/C13H28N2/c1-4-5-9-12(14)13(15(2)3)10-7-6-8-11-13/h12H,4-11,14H2,1-3H3
InChIKeyMBONJWSRXVWYBA-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-aminooctyl)-N,N-dimethylcyclopentan-1-amine
CID 79067548
1-(1-amino-5-methylhexyl)-N,N-dimethylcyclohexan-1-amine
CID 83160951
1-(1-amino-4-ethylsulfonylbutyl)-N,N-dimethylcycloheptan-1-amine
CID 79080747
1-(1-amino-4-methoxybutyl)-N,N-dimethylcycloheptan-1-amine
CID 114856330
1-(1-aminohex-5-enyl)-N,N-dimethylcyclopentan-1-amine
CID 79070597
1-(1-amino-4-phenylbutyl)-N,N-dimethylcyclohexan-1-amine
CID 79066143
1-[1-(dimethylamino)cycloheptyl]nonan-1-ol
CID 79074118
1-[1-(dimethylamino)cyclohexyl]butan-1-ol
CID 79066197
1-[1-(ethylamino)hexyl]-N,N-dimethylcycloheptan-1-amine
CID 79081785
1-(1-amino-2-cyclopentylethyl)-N,N-dimethylcycloheptan-1-amine
CID 79080652
1-(1-amino-3-methylbut-3-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79185474
1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
CID 79081577

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine (CID 79066659) is 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine is CCCCC(N)C1(N(C)C)CCCCC1.
What is the InChIKey of 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine?
The InChIKey is MBONJWSRXVWYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-5-9-12(14)13(15(2)3)10-7-6-8-11-13/h12H,4-11,14H2,1-3H3.
What are the key properties of 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine?
1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 79066659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).