N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide

C19H23N3O3 — CID 51091437

IUPACN-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide
SMILESCCCNC(=O)C(C)NC(=O)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C19H23N3O3/c1-3-10-21-18(23)14(2)22-19(24)16-9-11-20-17(12-16)25-13-15-7-5-4-6-8-15/h4-9,11-12,14H,3,10,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGVPJNUPAMPVXJX-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.31
Rot. Bonds8

About N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide

N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide (PubChem CID 51091437) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide
PubChem CID51091437
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide
SMILESCCCNC(=O)C(C)NC(=O)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C19H23N3O3/c1-3-10-21-18(23)14(2)22-19(24)16-9-11-20-17(12-16)25-13-15-7-5-4-6-8-15/h4-9,11-12,14H,3,10,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGVPJNUPAMPVXJX-UHFFFAOYSA-N
XLogP2.31
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-phenylmethoxypyridine-4-carboxamide
CID 47366269
2-(methylamino)-N-[1-oxo-1-(propylamino)propan-2-yl]pyridine-4-carboxamide
CID 55046580
N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
N-[[2-(hydroxymethyl)phenyl]methyl]-2-phenylmethoxypyridine-4-carboxamide
CID 110908784
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
CID 8750850
N-[(3-methyloxetan-3-yl)methyl]-2-phenylmethoxypyridine-4-carboxamide
CID 99122923
N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
CID 55996835
N-[1-[(2-methoxy-4-pyridinyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 86919506
2-[butan-2-yl-(2-phenylmethoxypyridine-4-carbonyl)amino]acetic acid
CID 120529904
3-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 7992878
3-bromo-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 51196385
N-(1,2-oxazol-5-ylmethyl)-2-phenylmethoxypyridine-4-carboxamide
CID 122141693

Frequently Asked Questions

What is the IUPAC name of N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide?
The IUPAC name of N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide (CID 51091437) is N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide.
What is the SMILES notation for N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide?
The canonical SMILES for N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide is CCCNC(=O)C(C)NC(=O)c1ccnc(OCc2ccccc2)c1.
What is the InChIKey of N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide?
The InChIKey is GVPJNUPAMPVXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-10-21-18(23)14(2)22-19(24)16-9-11-20-17(12-16)25-13-15-7-5-4-6-8-15/h4-9,11-12,14H,3,10,13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide?
N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.31, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylmethoxypyridine-4-carboxamide is sourced from PubChem (CID 51091437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).