N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide

C14H17N3O — CID 10060343

IUPACN,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(-n2cccc2)nc1
InChIInChI=1S/C14H17N3O/c1-3-16(4-2)14(18)12-7-8-13(15-11-12)17-9-5-6-10-17/h5-11H,3-4H2,1-2H3
InChIKeyYAQHJHPPTACVHZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.35
Rot. Bonds4

About N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide

N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide (PubChem CID 10060343) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide
PubChem CID10060343
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(-n2cccc2)nc1
InChIInChI=1S/C14H17N3O/c1-3-16(4-2)14(18)12-7-8-13(15-11-12)17-9-5-6-10-17/h5-11H,3-4H2,1-2H3
InChIKeyYAQHJHPPTACVHZ-UHFFFAOYSA-N
XLogP2.35
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-hydroxy-2-methylpropyl)-6-pyrrol-1-ylpyridine-3-carboxamide
CID 111970527
N,N-diethyl-4-pyrrol-1-ylbenzamide
CID 60682055
N-[(4-cyanophenyl)methyl]-N-[2-(dimethylamino)ethyl]-6-pyrrol-1-ylpyridine-3-carboxamide
CID 167942565
3-[ethyl-(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 61006797
N-ethyl-N-(pyridin-4-ylmethyl)-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
CID 91952867
N,N-diethyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109160359
N-benzyl-N-(2-hydroxyethyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 110886459
3-[ethyl-[6-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]propanoic acid
CID 61006798
N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160732
N-(2,2-dimethylpropylsulfonyl)-6-pyrrol-1-ylpyridine-3-carboxamide
CID 75377807
6-(azepan-1-yl)-N-ethyl-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 42596308
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide (CID 10060343) is N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide is CCN(CC)C(=O)c1ccc(-n2cccc2)nc1.
What is the InChIKey of N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide?
The InChIKey is YAQHJHPPTACVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-16(4-2)14(18)12-7-8-13(15-11-12)17-9-5-6-10-17/h5-11H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide?
N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-pyrrol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 10060343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).