1-cyclopentyl-N-ethyl-4-methylhexan-2-amine

C14H29N — CID 115846177

IUPAC1-cyclopentyl-N-ethyl-4-methylhexan-2-amine
SMILESCCNC(CC(C)CC)CC1CCCC1
InChIInChI=1S/C14H29N/c1-4-12(3)10-14(15-5-2)11-13-8-6-7-9-13/h12-15H,4-11H2,1-3H3
InChIKeyIJDKXEWLRTUKRI-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.98
Rot. Bonds7

About 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine

1-cyclopentyl-N-ethyl-4-methylhexan-2-amine (PubChem CID 115846177) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-4-methylhexan-2-amine
PubChem CID115846177
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name1-cyclopentyl-N-ethyl-4-methylhexan-2-amine
SMILESCCNC(CC(C)CC)CC1CCCC1
InChIInChI=1S/C14H29N/c1-4-12(3)10-14(15-5-2)11-13-8-6-7-9-13/h12-15H,4-11H2,1-3H3
InChIKeyIJDKXEWLRTUKRI-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-4-methyl-N-propylhexan-2-amine
CID 115846282
1,3-dicyclopentyl-N-ethylpropan-2-amine
CID 115847226
1-cyclobutyl-3-cyclopentyl-N-ethylpropan-2-amine
CID 115863503
1-cyclobutyl-N-ethyl-4,6,6-trimethylheptan-2-amine
CID 115863733
N-ethyl-4-methyl-1-(oxolan-3-yl)hexan-2-amine
CID 103987176
1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
CID 104986481
1-cycloheptyl-N-ethyl-3-methylpentan-1-amine
CID 65399965
1-cyclobutyl-N-ethyl-5-methylhexan-2-amine
CID 65458371
N-(3-cyclopentylpropyl)-5-methylheptan-3-amine
CID 114136708
1-cyclopentyl-N-ethyl-5-methoxyhexan-2-amine
CID 105138937
1-cyclopentyl-N,5-dimethylheptan-3-amine
CID 115846256
1-cyclohexyl-N-ethylpent-4-yn-2-amine
CID 114977293

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine?
The IUPAC name of 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine (CID 115846177) is 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine is CCNC(CC(C)CC)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine?
The InChIKey is IJDKXEWLRTUKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-12(3)10-14(15-5-2)11-13-8-6-7-9-13/h12-15H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine?
1-cyclopentyl-N-ethyl-4-methylhexan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-4-methylhexan-2-amine is sourced from PubChem (CID 115846177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).