N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine

C17H33N — CID 114201281

IUPACN-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine
SMILESCC(C)CC(C)CC(CNC1CC1)C1CCCC1
InChIInChI=1S/C17H33N/c1-13(2)10-14(3)11-16(12-18-17-8-9-17)15-6-4-5-7-15/h13-18H,4-12H2,1-3H3
InChIKeyZJCATZYXBBFHDG-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.62
Rot. Bonds8

About N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine

N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine (PubChem CID 114201281) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine
PubChem CID114201281
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC NameN-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine
SMILESCC(C)CC(C)CC(CNC1CC1)C1CCCC1
InChIInChI=1S/C17H33N/c1-13(2)10-14(3)11-16(12-18-17-8-9-17)15-6-4-5-7-15/h13-18H,4-12H2,1-3H3
InChIKeyZJCATZYXBBFHDG-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclohexyl-4-methylpentyl)cyclopropanamine
CID 82931479
N-[4,6-dimethyl-2-(2-methylpropyl)heptyl]cyclopropanamine
CID 114201229
N-[4-methyl-2-(2-methylpropyl)pentyl]cyclopropanamine
CID 62530308
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
2-cyclopentyl-4-methyl-N-propan-2-ylhexan-1-amine
CID 112569973
N-(2,3,5-trimethylhexyl)cyclopropanamine
CID 81016378
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
N-(2-cyclopentyl-4-ethoxybutyl)cyclopropanamine
CID 112570082
[(3S)-5-methylhexan-3-yl]cyclopentane
CID 152864730
2-cyclopentyl-4-methyl-N-propylheptan-1-amine
CID 112569912
N-(2-methylbutyl)cyclopentanamine
CID 43200714
N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
CID 103412730

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine?
The IUPAC name of N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine (CID 114201281) is N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine.
What is the SMILES notation for N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine?
The canonical SMILES for N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine is CC(C)CC(C)CC(CNC1CC1)C1CCCC1.
What is the InChIKey of N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine?
The InChIKey is ZJCATZYXBBFHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-13(2)10-14(3)11-16(12-18-17-8-9-17)15-6-4-5-7-15/h13-18H,4-12H2,1-3H3.
What are the key properties of N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine?
N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine has a molecular weight of 251.46 g/mol, XLogP of 4.62, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyl-4,6-dimethylheptyl)cyclopropanamine is sourced from PubChem (CID 114201281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).