N-pentan-3-ylpyridine-4-carboxamide

C11H16N2O — CID 137320352

IUPACN-pentan-3-ylpyridine-4-carboxamide
SMILESCCC(CC)NC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O/c1-3-10(4-2)13-11(14)9-5-7-12-8-6-9/h5-8,10H,3-4H2,1-2H3,(H,13,14)
InChIKeyFKOMICXOFPUGBU-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.00
Rot. Bonds4

About N-pentan-3-ylpyridine-4-carboxamide

N-pentan-3-ylpyridine-4-carboxamide (PubChem CID 137320352) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-pentan-3-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-pentan-3-ylpyridine-4-carboxamide
PubChem CID137320352
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-pentan-3-ylpyridine-4-carboxamide
SMILESCCC(CC)NC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O/c1-3-10(4-2)13-11(14)9-5-7-12-8-6-9/h5-8,10H,3-4H2,1-2H3,(H,13,14)
InChIKeyFKOMICXOFPUGBU-UHFFFAOYSA-N
XLogP2.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyanobutan-2-yl)pyridine-4-carboxamide
CID 62648128
2-bromo-N-pentan-3-ylpyridine-4-carboxamide
CID 103751828
N-[(1S)-1-(1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide
CID 140582861
N-[1-(ethylamino)-3-methyl-1-oxobutan-2-yl]pyridine-4-carboxamide
CID 130272140
N-(5-methylhexan-2-yl)pyridine-4-carboxamide
CID 42890124
N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
CID 103799473
N-(4-chlorobutan-2-yl)pyridine-4-carboxamide
CID 83178432
N-(1-amino-3-methyl-1-oxobutan-2-yl)pyridine-4-carboxamide
CID 77389901
N-[(2S)-1-hydroxybutan-2-yl]benzamide
CID 13129547
N-(1-bromobutan-2-yl)pyridazine-4-carboxamide
CID 104672670
N-(1-aminobutan-2-yl)pyridazine-4-carboxamide
CID 104671529
N-[1-(4-ethylphenyl)ethyl]pyridine-4-carboxamide
CID 6466147

Frequently Asked Questions

What is the IUPAC name of N-pentan-3-ylpyridine-4-carboxamide?
The IUPAC name of N-pentan-3-ylpyridine-4-carboxamide (CID 137320352) is N-pentan-3-ylpyridine-4-carboxamide.
What is the SMILES notation for N-pentan-3-ylpyridine-4-carboxamide?
The canonical SMILES for N-pentan-3-ylpyridine-4-carboxamide is CCC(CC)NC(=O)c1ccncc1.
What is the InChIKey of N-pentan-3-ylpyridine-4-carboxamide?
The InChIKey is FKOMICXOFPUGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-10(4-2)13-11(14)9-5-7-12-8-6-9/h5-8,10H,3-4H2,1-2H3,(H,13,14).
What are the key properties of N-pentan-3-ylpyridine-4-carboxamide?
N-pentan-3-ylpyridine-4-carboxamide has a molecular weight of 192.26 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-3-ylpyridine-4-carboxamide is sourced from PubChem (CID 137320352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).