N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine

C17H25N3 — CID 61034726

IUPACN-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine
SMILESCC(CNCc1c[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C17H25N3/c1-14(20-9-5-2-6-10-20)11-18-12-15-13-19-17-8-4-3-7-16(15)17/h3-4,7-8,13-14,18-19H,2,5-6,9-12H2,1H3
InChIKeyNLGKTCGAKPDHAL-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.13
Rot. Bonds5

About N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine

N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine (PubChem CID 61034726) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine
PubChem CID61034726
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC NameN-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine
SMILESCC(CNCc1c[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C17H25N3/c1-14(20-9-5-2-6-10-20)11-18-12-15-13-19-17-8-4-3-7-16(15)17/h3-4,7-8,13-14,18-19H,2,5-6,9-12H2,1H3
InChIKeyNLGKTCGAKPDHAL-UHFFFAOYSA-N
XLogP3.13
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-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

(2S)-N-benzyl-2-piperidin-1-ylpropan-1-amine
CID 92753834
3-(1H-indol-3-ylmethylamino)-2-methylpropanenitrile
CID 62646036
1-N-(1H-indol-3-ylmethyl)-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 55024666
2-amino-3-(1H-indol-3-ylmethylamino)propan-1-ol
CID 115120563
3-ethyl-1-(1H-indol-3-ylmethylamino)pentan-2-ol
CID 106284510
N-(1H-indol-3-ylmethyl)piperidine-1-carbothioamide
CID 10492515
1-cyclopropyl-2-(1H-indol-3-ylmethylamino)ethanol
CID 63295277
N-[(2-propan-2-yloxyphenyl)methyl]-2-pyrrolidin-1-ylpropan-1-amine
CID 112727650
(2R)-N-(1H-indol-3-ylmethyl)butan-2-amine
CID 92864086
1-amino-3-(1H-indol-3-ylmethylamino)propan-2-ol
CID 115121376
1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine
CID 62407326
(1H-indol-3-ylmethylamino)methanol
CID 115228988

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine?
The IUPAC name of N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine (CID 61034726) is N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine?
The canonical SMILES for N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine is CC(CNCc1c[nH]c2ccccc12)N1CCCCC1.
What is the InChIKey of N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine?
The InChIKey is NLGKTCGAKPDHAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-14(20-9-5-2-6-10-20)11-18-12-15-13-19-17-8-4-3-7-16(15)17/h3-4,7-8,13-14,18-19H,2,5-6,9-12H2,1H3.
What are the key properties of N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine?
N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine has a molecular weight of 271.41 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-ylmethyl)-2-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 61034726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).