1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine

C13H29N3 — CID 63166700

IUPAC1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNCCCCCN1CCC(N(C)C)C1
InChIInChI=1S/C13H29N3/c1-4-14-9-6-5-7-10-16-11-8-13(12-16)15(2)3/h13-14H,4-12H2,1-3H3
InChIKeyIIOMGLVFMZRHFF-UHFFFAOYSA-N
MW227.40 g/mol
LogP1.40
Rot. Bonds8

About 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine

1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine (PubChem CID 63166700) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine
PubChem CID63166700
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC Name1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNCCCCCN1CCC(N(C)C)C1
InChIInChI=1S/C13H29N3/c1-4-14-9-6-5-7-10-16-11-8-13(12-16)15(2)3/h13-14H,4-12H2,1-3H3
InChIKeyIIOMGLVFMZRHFF-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-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

1-(7-aminoheptyl)-N,N-dimethylpyrrolidin-3-amine
CID 63532634
1-(4-aminobutyl)-N,N-dimethylpyrrolidin-3-amine
CID 63166062
N,N-dimethyl-1-[2-(4-methylpentylamino)ethyl]pyrrolidin-3-amine
CID 63167526
N-ethyl-4-(3-methylpiperidin-1-yl)butan-1-amine
CID 62437965
6-[3-(dimethylamino)pyrrolidin-1-yl]-2-(ethylamino)-2-methylhexanoic acid
CID 63165554
5-(4-cyclopentylpiperazin-1-yl)-N-ethylpentan-1-amine
CID 62446737
N-ethyl-4-(4-propylpiperazin-1-yl)butan-1-amine
CID 62424325
N,N-dimethyl-1-[2-(pentan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 63167950
1-N-ethyl-4-N-(1-ethylpiperidin-4-yl)-4-N-methylpentane-1,4-diamine
CID 62436193
5-[4-[(dimethylamino)methyl]piperidin-1-yl]-N-propylpentan-1-amine
CID 55073746
N,N-dimethyl-1-[2-(3-methylbutan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 63167315
4-(4-cyclopentylpiperazin-1-yl)-N-ethylbutan-1-amine
CID 62448794

Frequently Asked Questions

What is the IUPAC name of 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine (CID 63166700) is 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine is CCNCCCCCN1CCC(N(C)C)C1.
What is the InChIKey of 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is IIOMGLVFMZRHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-4-14-9-6-5-7-10-16-11-8-13(12-16)15(2)3/h13-14H,4-12H2,1-3H3.
What are the key properties of 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine?
1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 227.40 g/mol, XLogP of 1.40, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(ethylamino)pentyl]-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 63166700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).