4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide

C10H15ClN2O2 — CID 43639802

IUPAC4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide
SMILESCCCn1cc(Cl)cc1C(=O)NCCO
InChIInChI=1S/C10H15ClN2O2/c1-2-4-13-7-8(11)6-9(13)10(15)12-3-5-14/h6-7,14H,2-5H2,1H3,(H,12,15)
InChIKeyUPOURDUOZXWOBP-UHFFFAOYSA-N
MW230.69 g/mol
LogP1.27
Rot. Bonds5

About 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide

4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide (PubChem CID 43639802) has the molecular formula C10H15ClN2O2 and a molecular weight of 230.69 g/mol. Its IUPAC name is 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide
PubChem CID43639802
Molecular FormulaC10H15ClN2O2
Molecular Weight230.69 g/mol
Exact Mass230.08
IUPAC Name4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide
SMILESCCCn1cc(Cl)cc1C(=O)NCCO
InChIInChI=1S/C10H15ClN2O2/c1-2-4-13-7-8(11)6-9(13)10(15)12-3-5-14/h6-7,14H,2-5H2,1H3,(H,12,15)
InChIKeyUPOURDUOZXWOBP-UHFFFAOYSA-N
XLogP1.27
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.69
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide 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

4-chloro-N-[2-(3-hydroxypropylsulfanyl)ethyl]-1-propylpyrrole-2-carboxamide
CID 106306233
4-chloro-N-hex-5-ynyl-1-propylpyrrole-2-carboxamide
CID 106209755
4-chloro-N-[2-(2-hydroxyethyl)pentyl]-1-propylpyrrole-2-carboxamide
CID 106115856
4-chloro-N-(2-hydroxypropyl)-1-propylpyrrole-2-carboxamide
CID 43639804
2-[[(4-chloro-1-propylpyrrole-2-carbonyl)amino]methyl]-3-methylbutanoic acid
CID 65220024
4-chloro-N-(1-hydroxy-4-methylpentan-2-yl)-1-propylpyrrole-2-carboxamide
CID 61246951
4-bromo-N-(3-hydroxypropyl)-1-propylpyrrole-2-carboxamide
CID 43639903
3-[(4-chloro-1-propylpyrrole-2-carbonyl)-methylamino]propanoic acid
CID 60989894
N-[(2R)-1-aminopropan-2-yl]-4-chloro-1-propylpyrrole-2-carboxamide
CID 104877038
4-chloro-1-propyl-N-(1H-pyrazol-5-ylmethyl)pyrrole-2-carboxamide
CID 61283741
4-chloro-N-(2-hydroxy-4-methoxy-2-methylbutyl)-1-propylpyrrole-2-carboxamide
CID 106250582
N-(3-aminopropyl)-4-chloro-1-ethylpyrrole-2-carboxamide
CID 62267384

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide?
The IUPAC name of 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide (CID 43639802) is 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide?
The canonical SMILES for 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide is CCCn1cc(Cl)cc1C(=O)NCCO.
What is the InChIKey of 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide?
The InChIKey is UPOURDUOZXWOBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O2/c1-2-4-13-7-8(11)6-9(13)10(15)12-3-5-14/h6-7,14H,2-5H2,1H3,(H,12,15).
What are the key properties of 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide?
4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide has a molecular weight of 230.69 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-hydroxyethyl)-1-propylpyrrole-2-carboxamide is sourced from PubChem (CID 43639802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).