4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide

C12H19N3O — CID 43643685

IUPAC4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)NC(C)C1CC1
InChIInChI=1S/C12H19N3O/c1-3-15-7-10(13)6-11(15)12(16)14-8(2)9-4-5-9/h6-9H,3-5,13H2,1-2H3,(H,14,16)
InChIKeyXYTXDTTURYCIHL-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.62
Rot. Bonds4

About 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide

4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide (PubChem CID 43643685) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide
PubChem CID43643685
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)NC(C)C1CC1
InChIInChI=1S/C12H19N3O/c1-3-15-7-10(13)6-11(15)12(16)14-8(2)9-4-5-9/h6-9H,3-5,13H2,1-2H3,(H,14,16)
InChIKeyXYTXDTTURYCIHL-UHFFFAOYSA-N
XLogP1.62
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-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-amino-N-(1-cyclohexylethyl)-1-propylpyrrole-2-carboxamide
CID 62403049
4-amino-N-(1-cyclopropylbutan-2-yl)-1-ethylpyrrole-2-carboxamide
CID 63995018
4-amino-1-ethyl-N-[(2S)-1-hydroxypropan-2-yl]pyrrole-2-carboxamide
CID 93254381
4-amino-1-ethyl-N-[(2R)-2-hydroxypropyl]pyrrole-2-carboxamide
CID 93254371
4-amino-1-ethyl-N-(2-hydroxypropyl)pyrrole-2-carboxamide
CID 43643619
4-amino-N-(1,1-dioxothian-4-yl)-1-ethylpyrrole-2-carboxamide
CID 43644123
4-amino-1-ethyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrrole-2-carboxamide
CID 61140181
4-amino-1-ethyl-N-[1-(4-methoxyphenyl)ethyl]pyrrole-2-carboxamide
CID 66197374
3,5-diamino-N-(1-cyclopropylethyl)benzamide
CID 61094229
4-amino-N-(3,5-dimethylcyclohexyl)-1-ethylpyrrole-2-carboxamide
CID 64733612
5-(1-cyclopropylethylcarbamoyl)-1-propylpyrrole-3-sulfonyl chloride
CID 114611217
4-amino-1-ethyl-N-(4-methylphenyl)pyrrole-2-carboxamide
CID 43642219

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide (CID 43643685) is 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide is CCn1cc(N)cc1C(=O)NC(C)C1CC1.
What is the InChIKey of 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide?
The InChIKey is XYTXDTTURYCIHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-15-7-10(13)6-11(15)12(16)14-8(2)9-4-5-9/h6-9H,3-5,13H2,1-2H3,(H,14,16).
What are the key properties of 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide?
4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclopropylethyl)-1-ethylpyrrole-2-carboxamide is sourced from PubChem (CID 43643685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).