3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine

C10H23N3 — CID 91162180

IUPAC3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine
SMILESCCNC(N)(N)CCC1CCCC1
InChIInChI=1S/C10H23N3/c1-2-13-10(11,12)8-7-9-5-3-4-6-9/h9,13H,2-8,11-12H2,1H3
InChIKeyKEPZRBMPWXXNGB-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.14
Rot. Bonds5

About 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine

3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine (PubChem CID 91162180) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine.

Molecular Properties

Compound Name3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine
PubChem CID91162180
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine
SMILESCCNC(N)(N)CCC1CCCC1
InChIInChI=1S/C10H23N3/c1-2-13-10(11,12)8-7-9-5-3-4-6-9/h9,13H,2-8,11-12H2,1H3
InChIKeyKEPZRBMPWXXNGB-UHFFFAOYSA-N
XLogP1.14
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-cyclohexyl-3-methylpentan-3-amine
CID 67766533
1-cyclobutyl-3-methylpentan-3-amine
CID 131227584
1-N"-ethylpropane-1,1,1-triamine
CID 155147575
2-cyclopentyl-N-ethylethanamine;hydrochloride
CID 3028141
propylcyclotetradecane
CID 90991550
1-cyclopentyl-2-methylpentan-2-amine
CID 65020465
1-cyclopentyl-3-(ethylamino)-3-methylbutan-2-one
CID 116566140
ethylcyclopentane;methanamine
CID 142068671
N-(cyclopentylmethyl)-3-methylpentan-3-amine
CID 103746706
butylcyclohexane;N-methylmethanamine
CID 174941558
1-N-(cyclohexylmethyl)-2-N-ethyl-1-N,2-dimethylpropane-1,2-diamine
CID 62834837
(3S)-5-cyclohexyl-3-methyl-3-(methylamino)pentan-2-one
CID 155643546

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine?
The IUPAC name of 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine (CID 91162180) is 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine.
What is the SMILES notation for 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine?
The canonical SMILES for 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine is CCNC(N)(N)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine?
The InChIKey is KEPZRBMPWXXNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-2-13-10(11,12)8-7-9-5-3-4-6-9/h9,13H,2-8,11-12H2,1H3.
What are the key properties of 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine?
3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine has a molecular weight of 185.31 g/mol, XLogP of 1.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-N"-ethylpropane-1,1,1-triamine is sourced from PubChem (CID 91162180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).