4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine

C15H31N — CID 115834516

IUPAC4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine
SMILESCCCNC(CCC(C)C)C1(C)CCCC1
InChIInChI=1S/C15H31N/c1-5-12-16-14(9-8-13(2)3)15(4)10-6-7-11-15/h13-14,16H,5-12H2,1-4H3
InChIKeyLUUXBMODWNQBSV-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds7

About 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine

4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine (PubChem CID 115834516) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine.

Molecular Properties

Compound Name4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine
PubChem CID115834516
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine
SMILESCCCNC(CCC(C)C)C1(C)CCCC1
InChIInChI=1S/C15H31N/c1-5-12-16-14(9-8-13(2)3)15(4)10-6-7-11-15/h13-14,16H,5-12H2,1-4H3
InChIKeyLUUXBMODWNQBSV-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
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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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The IUPAC name of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine (CID 115834516) is 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine.
What is the SMILES notation for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The canonical SMILES for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine is CCCNC(CCC(C)C)C1(C)CCCC1.
What is the InChIKey of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
The InChIKey is LUUXBMODWNQBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-5-12-16-14(9-8-13(2)3)15(4)10-6-7-11-15/h13-14,16H,5-12H2,1-4H3.
What are the key properties of 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine?
4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine is sourced from PubChem (CID 115834516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).