4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide

C15H25N3O — CID 81240413

IUPAC4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
SMILESCCCCCN(C(=O)c1cnccc1NC)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-6-7-10-18(12(2)3)15(19)13-11-17-9-8-14(13)16-4/h8-9,11-12H,5-7,10H2,1-4H3,(H,16,17)
InChIKeyRHYVUXKSUFQPTN-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.16
Rot. Bonds7

About 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide

4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 81240413) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
PubChem CID81240413
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
SMILESCCCCCN(C(=O)c1cnccc1NC)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-6-7-10-18(12(2)3)15(19)13-11-17-9-8-14(13)16-4/h8-9,11-12H,5-7,10H2,1-4H3,(H,16,17)
InChIKeyRHYVUXKSUFQPTN-UHFFFAOYSA-N
XLogP3.16
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-hydrazinyl-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 81255743
N-butan-2-yl-N-butyl-4-(ethylamino)pyridine-3-carboxamide
CID 81240030
2-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 62174306
4-chloro-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 81225564
N-heptan-2-yl-4-(methylamino)pyridine-3-carboxamide
CID 81240356
N-(2-hydroxyethyl)-4-(methylamino)-N-propylpyridine-3-carboxamide
CID 81242925
N-(2-hydroxypropyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81240291
N-methyl-4-(methylamino)-N-(2-methylbutyl)pyridine-3-carboxamide
CID 81236054
N-pentyl-N-propan-2-yl-2-(propylamino)benzamide
CID 62174124
N-(1-methoxypropan-2-yl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81242683
2-hydrazinyl-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 62247512
N-butan-2-yl-N-butyl-5-chloro-2-(methylamino)benzamide
CID 62177319

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide (CID 81240413) is 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide is CCCCCN(C(=O)c1cnccc1NC)C(C)C.
What is the InChIKey of 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is RHYVUXKSUFQPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-6-7-10-18(12(2)3)15(19)13-11-17-9-8-14(13)16-4/h8-9,11-12H,5-7,10H2,1-4H3,(H,16,17).
What are the key properties of 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide?
4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-pentyl-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 81240413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).