N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide

C15H26N2O3 — CID 106287615

IUPACN-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide
SMILESCCC(CC)C(O)CNC(=O)c1cccn1CCOC
InChIInChI=1S/C15H26N2O3/c1-4-12(5-2)14(18)11-16-15(19)13-7-6-8-17(13)9-10-20-3/h6-8,12,14,18H,4-5,9-11H2,1-3H3,(H,16,19)
InChIKeySUBDLAZJIXFBPS-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.66
Rot. Bonds9

About N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide

N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide (PubChem CID 106287615) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide
PubChem CID106287615
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC NameN-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide
SMILESCCC(CC)C(O)CNC(=O)c1cccn1CCOC
InChIInChI=1S/C15H26N2O3/c1-4-12(5-2)14(18)11-16-15(19)13-7-6-8-17(13)9-10-20-3/h6-8,12,14,18H,4-5,9-11H2,1-3H3,(H,16,19)
InChIKeySUBDLAZJIXFBPS-UHFFFAOYSA-N
XLogP1.66
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,2-difluoroethyl)-N-(3-ethyl-2-hydroxypentyl)pyrrole-2-carboxamide
CID 106287896
N-(3-amino-2-hydroxy-3-oxopropyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide
CID 114152525
2-methoxy-3-[(1-propylpyrrole-2-carbonyl)amino]propanoic acid
CID 106108154
3-[[1-(2-methoxyethyl)pyrrole-2-carbonyl]amino]propanoic acid
CID 114608589
1-(2-methoxyethyl)-N-pent-1-yn-3-ylpyrrole-2-carboxamide
CID 106227866
1-[1-(2-methoxyethyl)pyrrol-2-yl]ethanone
CID 45086402
N-[[1-(aminomethyl)cyclopropyl]methyl]-1-(2-methoxyethyl)pyrrole-2-carboxamide
CID 112748853
N-(2,3-dihydroxypropyl)-1-propylpyrrole-2-carboxamide
CID 66176682
N-(2,3-dihydroxy-2-methylpropyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide
CID 114609704
5-[[1-(2-methoxyethyl)pyrrole-2-carbonyl]amino]-2-methylpentanoic acid
CID 114609134
1-(2-methoxyethyl)-N-pent-4-ynylpyrrole-2-carboxamide
CID 106223251
N-[(4-hydroxyoxan-4-yl)methyl]-1-(2-methoxyethyl)pyrrole-2-carboxamide
CID 114609728

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide?
The IUPAC name of N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide (CID 106287615) is N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide.
What is the SMILES notation for N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide?
The canonical SMILES for N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide is CCC(CC)C(O)CNC(=O)c1cccn1CCOC.
What is the InChIKey of N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide?
The InChIKey is SUBDLAZJIXFBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-4-12(5-2)14(18)11-16-15(19)13-7-6-8-17(13)9-10-20-3/h6-8,12,14,18H,4-5,9-11H2,1-3H3,(H,16,19).
What are the key properties of N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide?
N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.66, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-hydroxypentyl)-1-(2-methoxyethyl)pyrrole-2-carboxamide is sourced from PubChem (CID 106287615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).