N-pentylpyridine-4-carboxamide

C11H16N2O — CID 2307296

IUPACN-pentylpyridine-4-carboxamide
SMILESCCCCCNC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O/c1-2-3-4-7-13-11(14)10-5-8-12-9-6-10/h5-6,8-9H,2-4,7H2,1H3,(H,13,14)
InChIKeyRFGBFUJGMVFKHW-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.00
Rot. Bonds5

About N-pentylpyridine-4-carboxamide

N-pentylpyridine-4-carboxamide (PubChem CID 2307296) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-pentylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-pentylpyridine-4-carboxamide
PubChem CID2307296
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-pentylpyridine-4-carboxamide
SMILESCCCCCNC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O/c1-2-3-4-7-13-11(14)10-5-8-12-9-6-10/h5-6,8-9H,2-4,7H2,1H3,(H,13,14)
InChIKeyRFGBFUJGMVFKHW-UHFFFAOYSA-N
XLogP2.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-hexylpyridine-4-carboxamide
CID 3423732
N-butylpyridine-4-carboxamide
CID 5030535
1-hexyl-3-(pyridine-4-carbonylamino)urea
CID 24975112
1-heptyl-3-(pyridine-4-carbonylamino)urea
CID 86577414
N'-undecylpyridine-4-carbohydrazide
CID 27387
methyl 6-(pyridine-4-carbonylamino)hexanoate
CID 39070425
N-octadecylpyridine-3-carboxamide
CID 3547337
CID 131885807
CID 131885807
4-bromo-N-pentylbenzamide
CID 4167913
N-decyl-4-hydroxybenzamide
CID 15277871
N-(4-aminooxybutyl)pyridine-4-carboxamide
CID 139932357
N-[3-(dimethylamino)propyl]pyridine-4-carboxamide;hydrochloride
CID 110755338

Frequently Asked Questions

What is the IUPAC name of N-pentylpyridine-4-carboxamide?
The IUPAC name of N-pentylpyridine-4-carboxamide (CID 2307296) is N-pentylpyridine-4-carboxamide.
What is the SMILES notation for N-pentylpyridine-4-carboxamide?
The canonical SMILES for N-pentylpyridine-4-carboxamide is CCCCCNC(=O)c1ccncc1.
What is the InChIKey of N-pentylpyridine-4-carboxamide?
The InChIKey is RFGBFUJGMVFKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-3-4-7-13-11(14)10-5-8-12-9-6-10/h5-6,8-9H,2-4,7H2,1H3,(H,13,14).
What are the key properties of N-pentylpyridine-4-carboxamide?
N-pentylpyridine-4-carboxamide has a molecular weight of 192.26 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentylpyridine-4-carboxamide is sourced from PubChem (CID 2307296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).