N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide

C15H23N3O — CID 81242322

IUPACN-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
SMILESCCCCN(C(=O)c1cnccc1NCC)C1CC1
InChIInChI=1S/C15H23N3O/c1-3-5-10-18(12-6-7-12)15(19)13-11-16-9-8-14(13)17-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyOCIHNKLRFAGFON-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.92
Rot. Bonds7

About N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide

N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide (PubChem CID 81242322) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
PubChem CID81242322
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
SMILESCCCCN(C(=O)c1cnccc1NCC)C1CC1
InChIInChI=1S/C15H23N3O/c1-3-5-10-18(12-6-7-12)15(19)13-11-16-9-8-14(13)17-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyOCIHNKLRFAGFON-UHFFFAOYSA-N
XLogP2.92
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-cyclopropyl-3-hydrazinylpyridine-4-carboxamide
CID 105071708
N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide
CID 81242615
N-butan-2-yl-N-butyl-4-(ethylamino)pyridine-3-carboxamide
CID 81240030
4-(ethylamino)-N-methyl-N-(oxan-4-yl)pyridine-3-carboxamide
CID 81243241
N-cyclopropyl-3-(methylamino)-N-propylpyridine-4-carboxamide
CID 105068558
N-butyl-N-cyclopropyl-2-(propylamino)benzamide
CID 62179116
4-(ethylamino)-N-methyl-N-(3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 114238290
N-cyclopentyl-N-ethyl-4-(methylamino)pyridine-3-carboxamide
CID 81242486
N-butyl-N-cyclopropyl-4-(ethylamino)-3-methylbenzamide
CID 63213660
4-(ethylamino)-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
CID 81241438
N-cyclopentyl-N-ethyl-4-hydrazinylpyridine-3-carboxamide
CID 81256694
4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 81242281

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide (CID 81242322) is N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide is CCCCN(C(=O)c1cnccc1NCC)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide?
The InChIKey is OCIHNKLRFAGFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-5-10-18(12-6-7-12)15(19)13-11-16-9-8-14(13)17-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17).
What are the key properties of N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide?
N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.92, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81242322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).