1-cycloheptyl-3-ethylpentan-2-amine

C14H29N — CID 105014024

IUPAC1-cycloheptyl-3-ethylpentan-2-amine
SMILESCCC(CC)C(N)CC1CCCCCC1
InChIInChI=1S/C14H29N/c1-3-13(4-2)14(15)11-12-9-7-5-6-8-10-12/h12-14H,3-11,15H2,1-2H3
InChIKeyIMZGPSMVOFPEAF-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.11
Rot. Bonds5

About 1-cycloheptyl-3-ethylpentan-2-amine

1-cycloheptyl-3-ethylpentan-2-amine (PubChem CID 105014024) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 1-cycloheptyl-3-ethylpentan-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-3-ethylpentan-2-amine
PubChem CID105014024
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name1-cycloheptyl-3-ethylpentan-2-amine
SMILESCCC(CC)C(N)CC1CCCCCC1
InChIInChI=1S/C14H29N/c1-3-13(4-2)14(15)11-12-9-7-5-6-8-10-12/h12-14H,3-11,15H2,1-2H3
InChIKeyIMZGPSMVOFPEAF-UHFFFAOYSA-N
XLogP4.11
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1-cyclohexyl-3-methylbutan-2-amine
CID 118964474
(2S)-2-amino-1-cyclohexylheptane-3,4,5-triol
CID 67724480
(2S)-1-cyclopentylbutan-2-amine
CID 58736664
(2-ethyl-3-methylpentyl)cyclohexane
CID 91213059
(2S,4R)-2,4-diamino-1,5-dicyclohexylpentan-3-ol
CID 10636664
1-cyclohexyl-3-methoxy-3-methylpentan-2-amine
CID 116757435
cyclohexanamine;(2S)-1-cyclohexylbutan-2-amine;cyclopentane;ethane
CID 143080326
(2S,3S,5R)-2-amino-1-cyclohexyl-5-ethylhept-6-en-3-ol
CID 70041382
1-cyclopropyl-3-methylpentan-2-amine
CID 64904257
azane;2-methylbutylcyclohexane
CID 143986613
2-cyclohexylpentan-3-amine
CID 79308576
(2R)-1-cyclohexylbutan-2-ol
CID 59949714

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-3-ethylpentan-2-amine?
The IUPAC name of 1-cycloheptyl-3-ethylpentan-2-amine (CID 105014024) is 1-cycloheptyl-3-ethylpentan-2-amine.
What is the SMILES notation for 1-cycloheptyl-3-ethylpentan-2-amine?
The canonical SMILES for 1-cycloheptyl-3-ethylpentan-2-amine is CCC(CC)C(N)CC1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-3-ethylpentan-2-amine?
The InChIKey is IMZGPSMVOFPEAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-3-13(4-2)14(15)11-12-9-7-5-6-8-10-12/h12-14H,3-11,15H2,1-2H3.
What are the key properties of 1-cycloheptyl-3-ethylpentan-2-amine?
1-cycloheptyl-3-ethylpentan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-3-ethylpentan-2-amine is sourced from PubChem (CID 105014024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).