4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide

C15H24N4O2 — CID 61115970

IUPAC4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1cc(N)cn1C1CC1
InChIInChI=1S/C15H24N4O2/c1-4-18(9-14(20)17-10(2)3)15(21)13-7-11(16)8-19(13)12-5-6-12/h7-8,10,12H,4-6,9,16H2,1-3H3,(H,17,20)
InChIKeyFMOOYAXGMPMDSS-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.39
Rot. Bonds6

About 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide

4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide (PubChem CID 61115970) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide
PubChem CID61115970
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1cc(N)cn1C1CC1
InChIInChI=1S/C15H24N4O2/c1-4-18(9-14(20)17-10(2)3)15(21)13-7-11(16)8-19(13)12-5-6-12/h7-8,10,12H,4-6,9,16H2,1-3H3,(H,17,20)
InChIKeyFMOOYAXGMPMDSS-UHFFFAOYSA-N
XLogP1.39
TPSA80.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-amino-2-oxoethyl)-1-cyclopropyl-N-ethylpyrrole-2-carboxamide
CID 103100900
4-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 61115969
4-bromo-1-cyclopropyl-N-ethyl-N-[2-(methylamino)-2-oxoethyl]pyrrole-2-carboxamide
CID 54877638
4-amino-1-cyclopropyl-N-ethyl-N-(4-methylphenyl)pyrrole-2-carboxamide
CID 62001599
4-amino-1-cyclopropyl-N-(2-methylpropyl)-N-pentan-3-ylpyrrole-2-carboxamide
CID 79489755
4-amino-1-cyclopropyl-N-(3-ethylpentan-2-yl)pyrrole-2-carboxamide
CID 63842385
4-amino-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 61106654
2-methylbutyl 4-amino-1-cyclopropylpyrrole-2-carboxylate
CID 62104592
4-amino-1-cyclopropyl-N-(4-hydroxybutan-2-yl)pyrrole-2-carboxamide
CID 83176737
4-amino-1-cyclopropyl-N-(3-methylbutan-2-yl)pyrrole-2-carboxamide
CID 43643307
4-amino-1-cyclopropyl-N-(2,3-dimethylbutyl)pyrrole-2-carboxamide
CID 64569791
ethyl 2-[(4-amino-1-cyclopropylpyrrole-2-carbonyl)-cyclopropylamino]acetate
CID 61115168

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide (CID 61115970) is 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide is CCN(CC(=O)NC(C)C)C(=O)c1cc(N)cn1C1CC1.
What is the InChIKey of 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide?
The InChIKey is FMOOYAXGMPMDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-18(9-14(20)17-10(2)3)15(21)13-7-11(16)8-19(13)12-5-6-12/h7-8,10,12H,4-6,9,16H2,1-3H3,(H,17,20).
What are the key properties of 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide?
4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrole-2-carboxamide is sourced from PubChem (CID 61115970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).