N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide

C22H26N4O — CID 166187462

IUPACN-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide
SMILESCC(c1ccccc1)N1CCC(NC(=O)Cc2c[nH]c3cnccc23)CC1
InChIInChI=1S/C22H26N4O/c1-16(17-5-3-2-4-6-17)26-11-8-19(9-12-26)25-22(27)13-18-14-24-21-15-23-10-7-20(18)21/h2-7,10,14-16,19,24H,8-9,11-13H2,1H3,(H,25,27)
InChIKeyHGFCMKWXVJEPKP-UHFFFAOYSA-N
MW362.48 g/mol
LogP3.45
Rot. Bonds5

About N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide

N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide (PubChem CID 166187462) has the molecular formula C22H26N4O and a molecular weight of 362.48 g/mol. Its IUPAC name is N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide
PubChem CID166187462
Molecular FormulaC22H26N4O
Molecular Weight362.48 g/mol
Exact Mass362.21
IUPAC NameN-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide
SMILESCC(c1ccccc1)N1CCC(NC(=O)Cc2c[nH]c3cnccc23)CC1
InChIInChI=1S/C22H26N4O/c1-16(17-5-3-2-4-6-17)26-11-8-19(9-12-26)25-22(27)13-18-14-24-21-15-23-10-7-20(18)21/h2-7,10,14-16,19,24H,8-9,11-13H2,1H3,(H,25,27)
InChIKeyHGFCMKWXVJEPKP-UHFFFAOYSA-N
XLogP3.45
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide 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-[1-(1-phenylethyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide
CID 119879223
2-(4-methylphenoxy)-N-[1-[(1S)-1-phenylethyl]piperidin-4-yl]acetamide
CID 97214154
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(1H-indol-3-yl)acetamide
CID 110819918
N-[(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]propanamide
CID 98726634
2-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
CID 91910721
N-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]-3-methylbutanamide
CID 110820676
N-[1-[(1S)-1-phenylethyl]piperidin-4-yl]-2-(4-propoxyphenoxy)acetamide
CID 99808583
3-amino-2-methyl-N-[1-(1-phenylethyl)piperidin-4-yl]butanamide
CID 120503779
N-[(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]pyridine-3-carboxamide
CID 94536313
2-methyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]propanamide
CID 47070507
2-methyl-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]propanamide
CID 94197653
2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-N-[1-(1-pyridin-4-ylethyl)piperidin-4-yl]acetamide
CID 166231856

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide?
The IUPAC name of N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide (CID 166187462) is N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide.
What is the SMILES notation for N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide?
The canonical SMILES for N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide is CC(c1ccccc1)N1CCC(NC(=O)Cc2c[nH]c3cnccc23)CC1.
What is the InChIKey of N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide?
The InChIKey is HGFCMKWXVJEPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O/c1-16(17-5-3-2-4-6-17)26-11-8-19(9-12-26)25-22(27)13-18-14-24-21-15-23-10-7-20(18)21/h2-7,10,14-16,19,24H,8-9,11-13H2,1H3,(H,25,27).
What are the key properties of N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide?
N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide has a molecular weight of 362.48 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-phenylethyl)piperidin-4-yl]-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetamide is sourced from PubChem (CID 166187462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).