4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide

C15H24N4O2 — CID 61109567

IUPAC4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide
SMILESCN(CC(=O)N(C)C1CCCCC1)C(=O)c1cc(N)c[nH]1
InChIInChI=1S/C15H24N4O2/c1-18(15(21)13-8-11(16)9-17-13)10-14(20)19(2)12-6-4-3-5-7-12/h8-9,12,17H,3-7,10,16H2,1-2H3
InChIKeyQEFDYHXDOPUJAS-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.46
Rot. Bonds4

About 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide

4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide (PubChem CID 61109567) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide
PubChem CID61109567
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide
SMILESCN(CC(=O)N(C)C1CCCCC1)C(=O)c1cc(N)c[nH]1
InChIInChI=1S/C15H24N4O2/c1-18(15(21)13-8-11(16)9-17-13)10-14(20)19(2)12-6-4-3-5-7-12/h8-9,12,17H,3-7,10,16H2,1-2H3
InChIKeyQEFDYHXDOPUJAS-UHFFFAOYSA-N
XLogP1.46
TPSA82.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N,N-dicyclohexyl-1H-pyrrole-2-carboxamide
CID 43642543
4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1H-pyrrole-2-carboxamide
CID 61114401
4-amino-N-methyl-N-(2-methylcyclohexyl)-1H-pyrrole-2-carboxamide
CID 61107798
4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide
CID 62687994
4-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrole-2-carboxamide
CID 63206983
4-amino-N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrrole-2-carboxamide
CID 63693899
[2-[cyclohexyl(methyl)amino]-2-oxoethyl] 4-chloro-1H-pyrrole-2-carboxylate
CID 18122871
3-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylpropanamide
CID 54873292
2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylpropanamide
CID 54873302
4-amino-N-[(3,5-dichlorophenyl)methyl]-N-methyl-1H-pyrrole-2-carboxamide
CID 61107986
4-amino-N-(3-methoxypropyl)-N-methyl-1H-pyrrole-2-carboxamide
CID 62984456
(2R)-2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N,3-dimethylbutanamide
CID 79012366

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide (CID 61109567) is 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide is CN(CC(=O)N(C)C1CCCCC1)C(=O)c1cc(N)c[nH]1.
What is the InChIKey of 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide?
The InChIKey is QEFDYHXDOPUJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-18(15(21)13-8-11(16)9-17-13)10-14(20)19(2)12-6-4-3-5-7-12/h8-9,12,17H,3-7,10,16H2,1-2H3.
What are the key properties of 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide?
4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 61109567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).