N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide

C15H25N3O — CID 105069100

IUPACN-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(CC)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-8-17-14-10-16-9-7-12(14)15(19)18-13(6-2)11(3)4/h7,9-11,13,17H,5-6,8H2,1-4H3,(H,18,19)
InChIKeyDJPNAOJAFZNDSS-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.07
Rot. Bonds7

About N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide

N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105069100) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105069100
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(CC)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-8-17-14-10-16-9-7-12(14)15(19)18-13(6-2)11(3)4/h7,9-11,13,17H,5-6,8H2,1-4H3,(H,18,19)
InChIKeyDJPNAOJAFZNDSS-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylhexan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105070483
4-(ethylamino)-N-(2-methylpentan-3-yl)pyridine-3-carboxamide
CID 81242327
N-[1-(dimethylamino)propan-2-yl]-3-(propylamino)pyridine-4-carboxamide
CID 105070967
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
4-chloro-N-(2-methylpentan-3-yl)pyridine-3-carboxamide
CID 81226748
3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 105068619
N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069520
N-(1-amino-3-methyl-1-oxobutan-2-yl)-3-(ethylamino)pyridine-4-carboxamide
CID 106347123
N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105067928
N-ethyl-N-propan-2-yl-3-(propylamino)pyridine-4-carboxamide
CID 105068541
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide (CID 105069100) is N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NC(CC)C(C)C.
What is the InChIKey of N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is DJPNAOJAFZNDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-8-17-14-10-16-9-7-12(14)15(19)18-13(6-2)11(3)4/h7,9-11,13,17H,5-6,8H2,1-4H3,(H,18,19).
What are the key properties of N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide?
N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105069100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).