1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine

C15H30N2 — CID 55088001

IUPAC1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine
SMILESCCCN(CC1CC1)C(C)CNC1CCCC1
InChIInChI=1S/C15H30N2/c1-3-10-17(12-14-8-9-14)13(2)11-16-15-6-4-5-7-15/h13-16H,3-12H2,1-2H3
InChIKeyFXSFRKKUXCXXIC-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds8

About 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine

1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine (PubChem CID 55088001) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine
PubChem CID55088001
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine
SMILESCCCN(CC1CC1)C(C)CNC1CCCC1
InChIInChI=1S/C15H30N2/c1-3-10-17(12-14-8-9-14)13(2)11-16-15-6-4-5-7-15/h13-16H,3-12H2,1-2H3
InChIKeyFXSFRKKUXCXXIC-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-cyclopentyl-2-N-[2-(dimethylamino)ethyl]-2-N-propylpropane-1,2-diamine
CID 55087417
2-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpropane-1,2-diamine
CID 62430049
1-N-cyclopropyl-2-N-(cyclopropylmethyl)-3-methyl-2-N-propylbutane-1,2-diamine
CID 62429335
1-N-butyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine
CID 62568153
1-N-cyclohexyl-2-N-(cyclohexylmethyl)-2-N-methylpropane-1,2-diamine
CID 62568908
N-cyclohexyl-N'-(cyclopropylmethyl)-N'-propan-2-ylethane-1,2-diamine
CID 62575675
1-N-cyclopentyl-2-N,2-N-dimethylpropane-1,2-diamine
CID 61044044
2-N-(cyclopropylmethyl)-1-N-propan-2-yl-2-N-propylbutane-1,2-diamine
CID 62430407
2-N-butyl-1-N-cyclopropyl-2-N-ethylpropane-1,2-diamine
CID 62424980
3-N-(cyclopropylmethyl)-2-methyl-1-N-(2-methylpropyl)-3-N-propylbutane-1,3-diamine
CID 81012962
1-N-cyclopentyl-2-N-methyl-2-N-(3-methylbutyl)propane-1,2-diamine
CID 62569636
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine?
The IUPAC name of 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine (CID 55088001) is 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine.
What is the SMILES notation for 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine?
The canonical SMILES for 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine is CCCN(CC1CC1)C(C)CNC1CCCC1.
What is the InChIKey of 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine?
The InChIKey is FXSFRKKUXCXXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-10-17(12-14-8-9-14)13(2)11-16-15-6-4-5-7-15/h13-16H,3-12H2,1-2H3.
What are the key properties of 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine?
1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopentyl-2-N-(cyclopropylmethyl)-2-N-propylpropane-1,2-diamine is sourced from PubChem (CID 55088001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).