1-cyclopentyl-4-methyl-N-propylhexan-2-amine

C15H31N — CID 115846282

IUPAC1-cyclopentyl-4-methyl-N-propylhexan-2-amine
SMILESCCCNC(CC(C)CC)CC1CCCC1
InChIInChI=1S/C15H31N/c1-4-10-16-15(11-13(3)5-2)12-14-8-6-7-9-14/h13-16H,4-12H2,1-3H3
InChIKeyIGNGAZWMDSAZQY-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds8

About 1-cyclopentyl-4-methyl-N-propylhexan-2-amine

1-cyclopentyl-4-methyl-N-propylhexan-2-amine (PubChem CID 115846282) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-cyclopentyl-4-methyl-N-propylhexan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-4-methyl-N-propylhexan-2-amine
PubChem CID115846282
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-cyclopentyl-4-methyl-N-propylhexan-2-amine
SMILESCCCNC(CC(C)CC)CC1CCCC1
InChIInChI=1S/C15H31N/c1-4-10-16-15(11-13(3)5-2)12-14-8-6-7-9-14/h13-16H,4-12H2,1-3H3
InChIKeyIGNGAZWMDSAZQY-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-N-ethyl-4-methylhexan-2-amine
CID 115846177
1-cyclopropyl-4-methyl-N-propylpentan-2-amine
CID 64903821
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
1-cycloheptyl-5-methyl-N-propylhexan-2-amine
CID 115834105
N-(3-cyclopentylpropyl)-5-methylheptan-3-amine
CID 114136708
1-cyclohexylsulfanyl-4-methyl-N-propylhexan-2-amine
CID 65144446
1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
CID 115863549
1-cyclopentyl-3-(2-methylpropylsulfanyl)-N-propylpropan-2-amine
CID 65134979
1-cyclobutyl-3-propan-2-yloxy-N-propylpropan-2-amine
CID 105151820
1-cyclopentyl-N-propyldodecan-2-amine
CID 115845917
1-cyclopentyl-4,4,4-trifluoro-N-propylbutan-2-amine
CID 62604821
1-cyclopentyl-N-propylhex-5-en-2-amine
CID 104987521

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-methyl-N-propylhexan-2-amine?
The IUPAC name of 1-cyclopentyl-4-methyl-N-propylhexan-2-amine (CID 115846282) is 1-cyclopentyl-4-methyl-N-propylhexan-2-amine.
What is the SMILES notation for 1-cyclopentyl-4-methyl-N-propylhexan-2-amine?
The canonical SMILES for 1-cyclopentyl-4-methyl-N-propylhexan-2-amine is CCCNC(CC(C)CC)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-4-methyl-N-propylhexan-2-amine?
The InChIKey is IGNGAZWMDSAZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-10-16-15(11-13(3)5-2)12-14-8-6-7-9-14/h13-16H,4-12H2,1-3H3.
What are the key properties of 1-cyclopentyl-4-methyl-N-propylhexan-2-amine?
1-cyclopentyl-4-methyl-N-propylhexan-2-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-methyl-N-propylhexan-2-amine is sourced from PubChem (CID 115846282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).