1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine

C18H34N2 — CID 166972958

IUPAC1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine
SMILESCCCC(CN(C1CCC1)C1CCC1)NC1CCCC1
InChIInChI=1S/C18H34N2/c1-2-7-16(19-15-8-3-4-9-15)14-20(17-10-5-11-17)18-12-6-13-18/h15-19H,2-14H2,1H3
InChIKeyVNPQTTAYSVOLGR-UHFFFAOYSA-N
MW278.48 g/mol
LogP4.09
Rot. Bonds8

About 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine

1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine (PubChem CID 166972958) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine
PubChem CID166972958
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine
SMILESCCCC(CN(C1CCC1)C1CCC1)NC1CCCC1
InChIInChI=1S/C18H34N2/c1-2-7-16(19-15-8-3-4-9-15)14-20(17-10-5-11-17)18-12-6-13-18/h15-19H,2-14H2,1H3
InChIKeyVNPQTTAYSVOLGR-UHFFFAOYSA-N
XLogP4.09
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 103920845
N-pentan-2-ylcyclooctanamine
CID 43079432
1-N-hexan-3-ylcyclohexane-1,3-diamine
CID 79458783
1,1-dicyclohexyl-2-hexan-3-ylhydrazine
CID 44598614
3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64797687
N-heptan-4-yl-1-methylpiperidin-4-amine
CID 43373353
4-methyl-N-pentan-3-ylcycloheptan-1-amine
CID 65081260
N-octan-4-yl-3-(trifluoromethyl)cyclohexan-1-amine
CID 106023449
N'-cyclopentyl-N-heptan-4-yl-N'-methylethane-1,2-diamine
CID 55205255
N-(1-methoxyhexan-2-yl)cyclopentanamine
CID 115704960

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine?
The IUPAC name of 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine (CID 166972958) is 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine.
What is the SMILES notation for 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine?
The canonical SMILES for 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine is CCCC(CN(C1CCC1)C1CCC1)NC1CCCC1.
What is the InChIKey of 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine?
The InChIKey is VNPQTTAYSVOLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-2-7-16(19-15-8-3-4-9-15)14-20(17-10-5-11-17)18-12-6-13-18/h15-19H,2-14H2,1H3.
What are the key properties of 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine?
1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine has a molecular weight of 278.48 g/mol, XLogP of 4.09, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine is sourced from PubChem (CID 166972958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).