2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine

C19H38N2 — CID 63494602

IUPAC2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine
SMILESCCCNCC(C)(CCC)CN1CCCC1C1CCCC1
InChIInChI=1S/C19H38N2/c1-4-12-19(3,15-20-13-5-2)16-21-14-8-11-18(21)17-9-6-7-10-17/h17-18,20H,4-16H2,1-3H3
InChIKeyCNVNDYMJGQMVCR-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.45
Rot. Bonds9

About 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine

2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine (PubChem CID 63494602) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine.

Molecular Properties

Compound Name2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine
PubChem CID63494602
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine
SMILESCCCNCC(C)(CCC)CN1CCCC1C1CCCC1
InChIInChI=1S/C19H38N2/c1-4-12-19(3,15-20-13-5-2)16-21-14-8-11-18(21)17-9-6-7-10-17/h17-18,20H,4-16H2,1-3H3
InChIKeyCNVNDYMJGQMVCR-UHFFFAOYSA-N
XLogP4.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]-2-methylpentyl]cyclopropanamine
CID 102728269
[1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-2-yl]methanol
CID 62260314
N-[2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)-2-methylpentyl]cyclopropanamine
CID 82751638
N-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)ethyl]propan-1-amine
CID 61387310
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-N-propylpropan-1-amine
CID 55070651
6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-propylhexan-1-amine
CID 102728574
4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-3,3-dimethyl-N-propylbutan-2-amine
CID 66454058
2-[(2,3-dimethylpiperidin-1-yl)methyl]-N-ethyl-2-methylpentan-1-amine
CID 62256342
1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-3-ol
CID 55131551
2-(cyclopentylmethyl)-2-methyl-N-propylpentan-1-amine
CID 63508725
2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-ethyl-N-methylbutan-1-amine
CID 62258697
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-methyl-3-(propan-2-ylamino)propan-2-ol
CID 102725900

Frequently Asked Questions

What is the IUPAC name of 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine?
The IUPAC name of 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine (CID 63494602) is 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine.
What is the SMILES notation for 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine?
The canonical SMILES for 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine is CCCNCC(C)(CCC)CN1CCCC1C1CCCC1.
What is the InChIKey of 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine?
The InChIKey is CNVNDYMJGQMVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-4-12-19(3,15-20-13-5-2)16-21-14-8-11-18(21)17-9-6-7-10-17/h17-18,20H,4-16H2,1-3H3.
What are the key properties of 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine?
2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.45, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2-methyl-N-propylpentan-1-amine is sourced from PubChem (CID 63494602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).