N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide

C17H19ClN4O — CID 19296648

IUPACN-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide
SMILESCCn1ncc(Cl)c1CNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C17H19ClN4O/c1-2-22-16(14(18)10-21-22)11-20-17(23)8-7-12-9-19-15-6-4-3-5-13(12)15/h3-6,9-10,19H,2,7-8,11H2,1H3,(H,20,23)
InChIKeyPFGHQABHYJYNCQ-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.29
Rot. Bonds6

About N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide

N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide (PubChem CID 19296648) has the molecular formula C17H19ClN4O and a molecular weight of 330.82 g/mol. Its IUPAC name is N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide
PubChem CID19296648
Molecular FormulaC17H19ClN4O
Molecular Weight330.82 g/mol
Exact Mass330.12
IUPAC NameN-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide
SMILESCCn1ncc(Cl)c1CNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C17H19ClN4O/c1-2-22-16(14(18)10-21-22)11-20-17(23)8-7-12-9-19-15-6-4-3-5-13(12)15/h3-6,9-10,19H,2,7-8,11H2,1H3,(H,20,23)
InChIKeyPFGHQABHYJYNCQ-UHFFFAOYSA-N
XLogP3.29
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide 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-[(4-bromo-1-ethylpyrazol-5-yl)methyl]-4-(1H-indol-3-yl)butanamide
CID 19322988
N-[(1-ethylpyrazol-3-yl)methyl]-3-(1H-indol-3-yl)propanamide
CID 19330998
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3-(1H-indol-3-yl)propanamide
CID 26447481
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 17473957
3-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide
CID 4806902
N-[[4-(dimethylamino)phenyl]methyl]-3-(1H-indol-3-yl)propanamide
CID 17478687
N-(2-chloroprop-2-enyl)-3-(1H-indol-3-yl)propanamide
CID 115636757
3-(1H-indol-3-yl)-N-[(3-methyl-2-methylsulfanylimidazol-4-yl)methyl]propanamide
CID 91765313
N-[(2-bromophenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 70209057
N-hydroxy-3-(1H-indol-3-yl)propanamide
CID 23938574
N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
CID 43591658

Frequently Asked Questions

What is the IUPAC name of N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide (CID 19296648) is N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide is CCn1ncc(Cl)c1CNC(=O)CCc1c[nH]c2ccccc12.
What is the InChIKey of N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide?
The InChIKey is PFGHQABHYJYNCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN4O/c1-2-22-16(14(18)10-21-22)11-20-17(23)8-7-12-9-19-15-6-4-3-5-13(12)15/h3-6,9-10,19H,2,7-8,11H2,1H3,(H,20,23).
What are the key properties of N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide?
N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide has a molecular weight of 330.82 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 19296648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).