4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide

C15H24N4O — CID 61139290

IUPAC4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide
SMILESCCN1CCC(NC(=O)c2cc(N)cn2C2CC2)CC1
InChIInChI=1S/C15H24N4O/c1-2-18-7-5-12(6-8-18)17-15(20)14-9-11(16)10-19(14)13-3-4-13/h9-10,12-13H,2-8,16H2,1H3,(H,17,20)
InChIKeyRIGYBEGQENKQJN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.62
Rot. Bonds4

About 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide

4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide (PubChem CID 61139290) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide
PubChem CID61139290
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide
SMILESCCN1CCC(NC(=O)c2cc(N)cn2C2CC2)CC1
InChIInChI=1S/C15H24N4O/c1-2-18-7-5-12(6-8-18)17-15(20)14-9-11(16)10-19(14)13-3-4-13/h9-10,12-13H,2-8,16H2,1H3,(H,17,20)
InChIKeyRIGYBEGQENKQJN-UHFFFAOYSA-N
XLogP1.62
TPSA63.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-1-ethyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide
CID 61139100
4-amino-1-cyclopropyl-N-(1-methylpyrrolidin-3-yl)pyrrole-2-carboxamide
CID 54949762
4-amino-N-(1-ethylpiperidin-4-yl)-1-propan-2-ylpyrrole-2-carboxamide
CID 61139289
4-amino-1-cyclopropyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]pyrrole-2-carboxamide
CID 107864320
4-amino-1-cyclopropyl-N-(2-ethoxyethyl)pyrrole-2-carboxamide
CID 43644088
4-amino-1-cyclopropyl-N-(1-methyl-2-oxopyrrolidin-3-yl)pyrrole-2-carboxamide
CID 106249461
4-amino-1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]pyrrole-2-carboxamide
CID 107211253
4-amino-1-methyl-N-(1-methylpiperidin-4-yl)pyrrole-2-carboxamide
CID 43643546
4-amino-1-cyclopropyl-N-(6-oxopiperidin-3-yl)pyrrole-2-carboxamide
CID 63661508
4-amino-N-(3-amino-3-oxopropyl)-1-cyclopropylpyrrole-2-carboxamide
CID 43643776
5-amino-N-(1-ethylpiperidin-4-yl)-2-fluorobenzamide
CID 61138909
4-amino-1-cyclopropyl-N-[(4-ethylphenyl)methyl]pyrrole-2-carboxamide
CID 106899099

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide (CID 61139290) is 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide is CCN1CCC(NC(=O)c2cc(N)cn2C2CC2)CC1.
What is the InChIKey of 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide?
The InChIKey is RIGYBEGQENKQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-18-7-5-12(6-8-18)17-15(20)14-9-11(16)10-19(14)13-3-4-13/h9-10,12-13H,2-8,16H2,1H3,(H,17,20).
What are the key properties of 4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide?
4-amino-1-cyclopropyl-N-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.62, 4 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-(1-ethylpiperidin-4-yl)pyrrole-2-carboxamide is sourced from PubChem (CID 61139290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).