N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine

C20H23N3 — CID 141333919

IUPACN-(1-benzylpiperidin-4-yl)-1H-indol-2-amine
SMILESc1ccc(CN2CCC(Nc3cc4ccccc4[nH]3)CC2)cc1
InChIInChI=1S/C20H23N3/c1-2-6-16(7-3-1)15-23-12-10-18(11-13-23)21-20-14-17-8-4-5-9-19(17)22-20/h1-9,14,18,21-22H,10-13,15H2
InChIKeyTXWGPMCIZQKIQB-UHFFFAOYSA-N
MW305.43 g/mol
LogP4.24
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine

N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine (PubChem CID 141333919) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-1H-indol-2-amine
PubChem CID141333919
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC NameN-(1-benzylpiperidin-4-yl)-1H-indol-2-amine
SMILESc1ccc(CN2CCC(Nc3cc4ccccc4[nH]3)CC2)cc1
InChIInChI=1S/C20H23N3/c1-2-6-16(7-3-1)15-23-12-10-18(11-13-23)21-20-14-17-8-4-5-9-19(17)22-20/h1-9,14,18,21-22H,10-13,15H2
InChIKeyTXWGPMCIZQKIQB-UHFFFAOYSA-N
XLogP4.24
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-benzylpiperidin-4-yl)-1H-indol-2-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

3-[[(1-benzylpiperidin-4-yl)amino]methyl]-1H-quinolin-2-one
CID 119136081
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
2-[(1-benzylpiperidin-4-yl)amino]-4-methyl-1H-pyrimidin-6-one
CID 135719651
3-[(1-benzylpiperidin-4-yl)amino]phenol
CID 28722324
6-N-(1-benzylpiperidin-4-yl)-2-N-ethyl-3,5-difluoropyridine-2,6-diamine
CID 114074043
2-N,4-N-bis(1-benzylpiperidin-4-yl)-6-methylpyrimidine-2,4-diamine
CID 117084915
1-benzyl-N-(1H-pyrazol-4-yl)piperidin-4-amine
CID 43540095
N-(1-benzylpiperidin-4-yl)-5-chloro-1H-indole-2-carboxamide
CID 2814764
N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-[3-(1H-indol-2-yl)phenyl]piperidin-4-amine
CID 140939089
2-N-(1-benzylpiperidin-4-yl)-4-chlorobenzene-1,2-diamine
CID 22922520
2-N,4-N-bis(1-benzylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 117081882
N-(1-benzylpiperidin-4-yl)-5-bromopyridin-3-amine
CID 115656855

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine (CID 141333919) is N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine is c1ccc(CN2CCC(Nc3cc4ccccc4[nH]3)CC2)cc1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine?
The InChIKey is TXWGPMCIZQKIQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3/c1-2-6-16(7-3-1)15-23-12-10-18(11-13-23)21-20-14-17-8-4-5-9-19(17)22-20/h1-9,14,18,21-22H,10-13,15H2.
What are the key properties of N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine?
N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine has a molecular weight of 305.43 g/mol, XLogP of 4.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-1H-indol-2-amine is sourced from PubChem (CID 141333919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).