2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine

C15H31N — CID 63508725

IUPAC2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine
SMILESCCCNCC(C)(CCC)CC1CCCC1
InChIInChI=1S/C15H31N/c1-4-10-15(3,13-16-11-5-2)12-14-8-6-7-9-14/h14,16H,4-13H2,1-3H3
InChIKeyRGAVEGKMSUWJEN-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds8

About 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine

2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine (PubChem CID 63508725) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine
PubChem CID63508725
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine
SMILESCCCNCC(C)(CCC)CC1CCCC1
InChIInChI=1S/C15H31N/c1-4-10-15(3,13-16-11-5-2)12-14-8-6-7-9-14/h14,16H,4-13H2,1-3H3
InChIKeyRGAVEGKMSUWJEN-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopentylmethyl)-N-ethyl-2-methylpentan-1-amine
CID 63507341
4-cyclohexyl-2-ethyl-2-methyl-N-propylbutan-1-amine
CID 114192517
2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine
CID 63494602
N,2-dimethyl-2-(oxan-4-ylmethyl)pentan-1-amine
CID 62725215
N-(1-cyclopropylethyl)-N,2-dimethyl-N',2-dipropylpropane-1,3-diamine
CID 62256297
[1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-2-yl]methanol
CID 62260314
N,2-dimethyl-N-(oxan-4-ylmethyl)-N',2-dipropylpropane-1,3-diamine
CID 63713052
N-(cyclohexylmethyl)-N'-ethyl-N,2-dimethyl-2-propylpropane-1,3-diamine
CID 63495625
2-cyclopropyl-2-ethyl-N-propylbutan-1-amine
CID 104819389
N'-(cyclohexylmethyl)-N-propylethane-1,2-diamine
CID 62559758
1-cyclopentyl-2-methylpentan-2-amine
CID 65020465
8-[2-methyl-2-(propylaminomethyl)pentyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63768757

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine?
The IUPAC name of 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine (CID 63508725) is 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine.
What is the SMILES notation for 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine?
The canonical SMILES for 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine is CCCNCC(C)(CCC)CC1CCCC1.
What is the InChIKey of 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine?
The InChIKey is RGAVEGKMSUWJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-10-15(3,13-16-11-5-2)12-14-8-6-7-9-14/h14,16H,4-13H2,1-3H3.
What are the key properties of 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine?
2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-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 2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine is sourced from PubChem (CID 63508725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).