1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine

C18H29N3 — CID 115303946

IUPAC1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C2CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C18H29N3/c1-18(19-2)9-12-21(13-10-18)17-8-11-20(15-17)14-16-6-4-3-5-7-16/h3-7,17,19H,8-15H2,1-2H3
InChIKeyNJFKTLIBGWFYKA-UHFFFAOYSA-N
MW287.45 g/mol
LogP2.33
Rot. Bonds4

About 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine

1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine (PubChem CID 115303946) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine
PubChem CID115303946
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C2CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C18H29N3/c1-18(19-2)9-12-21(13-10-18)17-8-11-20(15-17)14-16-6-4-3-5-7-16/h3-7,17,19H,8-15H2,1-2H3
InChIKeyNJFKTLIBGWFYKA-UHFFFAOYSA-N
XLogP2.33
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-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-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
CID 162433803
[4-(1-benzylpyrrolidin-3-yl)piperazin-1-yl]-(1-ethylcyclopropyl)methanone
CID 136542264
1-(1-benzylpyrrolidin-3-yl)-4-methylpyrrolidin-3-amine
CID 103575535
(9aR)-2-benzyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 86333935
1-(1-benzylpyrrolidin-3-yl)piperidin-3-amine
CID 61296822
1-(1-benzylpyrrolidin-3-yl)-5-methylpiperidin-3-amine
CID 79986204
N-methyl-1-[3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]phenyl]methanamine
CID 63167107
8-(1-benzylpiperidin-4-yl)-1-methyl-1,8-diazaspiro[4.5]decane
CID 145314400
1-(1-benzylpiperidin-4-yl)azocane
CID 2846402
1-(1-benzylpyrrolidin-3-yl)-N-methylmethanamine
CID 4660832
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
(3S,4S)-1-benzyl-4-chloro-3-methylpiperidine
CID 97176910

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine (CID 115303946) is 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine is CNC1(C)CCN(C2CCN(Cc3ccccc3)C2)CC1.
What is the InChIKey of 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine?
The InChIKey is NJFKTLIBGWFYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-18(19-2)9-12-21(13-10-18)17-8-11-20(15-17)14-16-6-4-3-5-7-16/h3-7,17,19H,8-15H2,1-2H3.
What are the key properties of 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine?
1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine has a molecular weight of 287.45 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 115303946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).