N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide

C15H21N5O — CID 105069520

IUPACN-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(C)Cn1ccnc1
InChIInChI=1S/C15H21N5O/c1-3-5-18-14-9-16-6-4-13(14)15(21)19-12(2)10-20-8-7-17-11-20/h4,6-9,11-12,18H,3,5,10H2,1-2H3,(H,19,21)
InChIKeyHZDZRFNYTJNZIR-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.92
Rot. Bonds7

About N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide

N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105069520) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105069520
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(C)Cn1ccnc1
InChIInChI=1S/C15H21N5O/c1-3-5-18-14-9-16-6-4-13(14)15(21)19-12(2)10-20-8-7-17-11-20/h4,6-9,11-12,18H,3,5,10H2,1-2H3,(H,19,21)
InChIKeyHZDZRFNYTJNZIR-UHFFFAOYSA-N
XLogP1.92
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(dimethylamino)propan-2-yl]-3-(propylamino)pyridine-4-carboxamide
CID 105070967
N-(4-methylhexan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105070483
N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069100
2-fluoro-N-[(2S)-1-imidazol-1-ylpropan-2-yl]benzamide
CID 93422582
2-fluoro-N-[(2R)-1-imidazol-1-ylpropan-2-yl]benzamide
CID 93422583
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 105068619
5-bromo-N-(1-imidazol-1-ylpropan-2-yl)-2-methylbenzamide
CID 65311773
N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105067928
3-(ethylamino)-N-(5-methylhexan-2-yl)pyridine-4-carboxamide
CID 105070222
3-fluoro-N-(1-imidazol-1-ylpropan-2-yl)-2-(methylamino)pyridine-4-carboxamide
CID 105385748
2,5-dichloro-N-(1-imidazol-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 114917693

Frequently Asked Questions

What is the IUPAC name of N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide (CID 105069520) is N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NC(C)Cn1ccnc1.
What is the InChIKey of N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is HZDZRFNYTJNZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-5-18-14-9-16-6-4-13(14)15(21)19-12(2)10-20-8-7-17-11-20/h4,6-9,11-12,18H,3,5,10H2,1-2H3,(H,19,21).
What are the key properties of N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide?
N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.92, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105069520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).