1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine

C16H31N — CID 115863549

IUPAC1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
SMILESCCCNC(CCC1CCCC1)CC1CCC1
InChIInChI=1S/C16H31N/c1-2-12-17-16(13-15-8-5-9-15)11-10-14-6-3-4-7-14/h14-17H,2-13H2,1H3
InChIKeyCBGFCYSWVJFNLK-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.52
Rot. Bonds8

About 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine

1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine (PubChem CID 115863549) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
PubChem CID115863549
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
SMILESCCCNC(CCC1CCCC1)CC1CCC1
InChIInChI=1S/C16H31N/c1-2-12-17-16(13-15-8-5-9-15)11-10-14-6-3-4-7-14/h14-17H,2-13H2,1H3
InChIKeyCBGFCYSWVJFNLK-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-cyclohexyl-1-(oxan-4-yl)-N-propylbutan-2-amine
CID 115846851
1-cyclohexyl-N-propylhexan-3-amine
CID 63400154
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
1-cycloheptyl-5-methyl-N-propylhexan-2-amine
CID 115834105
1-cyclopentyl-N-propyldodecan-2-amine
CID 115845917
1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine
CID 104992726
1-cyclopentyl-N-propylhex-5-en-2-amine
CID 104987521
1-cyclohexyl-4-methylsulfanyl-N-propylbutan-2-amine
CID 105135576
1-cyclohexyl-6,6-dimethyl-N-propylheptan-3-amine
CID 115849970
1-cyclopentyl-4,4,4-trifluoro-N-propylbutan-2-amine
CID 62604821
4-cyclohexyl-1-ethoxy-N-propylbutan-2-amine
CID 105008032
1-cyclopentyl-5-ethoxy-N-propylpentan-2-amine
CID 105139073

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine?
The IUPAC name of 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine (CID 115863549) is 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine.
What is the SMILES notation for 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine?
The canonical SMILES for 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine is CCCNC(CCC1CCCC1)CC1CCC1.
What is the InChIKey of 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine?
The InChIKey is CBGFCYSWVJFNLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-2-12-17-16(13-15-8-5-9-15)11-10-14-6-3-4-7-14/h14-17H,2-13H2,1H3.
What are the key properties of 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine?
1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine has a molecular weight of 237.43 g/mol, XLogP of 4.52, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine is sourced from PubChem (CID 115863549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).