N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide

C17H18N2O3 — CID 111539349

IUPACN-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
SMILESO=C(NCC1(O)CCC1)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C17H18N2O3/c20-16(19-12-17(21)9-4-10-17)13-7-8-15(18-11-13)22-14-5-2-1-3-6-14/h1-3,5-8,11,21H,4,9-10,12H2,(H,19,20)
InChIKeyUCNLZIHHSGVSEJ-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.52
Rot. Bonds5

About N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide

N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide (PubChem CID 111539349) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
PubChem CID111539349
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
SMILESO=C(NCC1(O)CCC1)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C17H18N2O3/c20-16(19-12-17(21)9-4-10-17)13-7-8-15(18-11-13)22-14-5-2-1-3-6-14/h1-3,5-8,11,21H,4,9-10,12H2,(H,19,20)
InChIKeyUCNLZIHHSGVSEJ-UHFFFAOYSA-N
XLogP2.52
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111333099
N-[(1-hydroxycyclobutyl)methyl]-4-phenoxybenzamide
CID 111445607
2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
CID 163226654
N-(2-methoxyethyl)-6-phenoxypyridine-3-carboxamide
CID 87000425
N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
CID 78888027
N-[2-[(4-chlorobenzoyl)amino]ethyl]-6-phenoxypyridine-3-carboxamide
CID 78888100
6-(dimethylamino)-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-carboxamide
CID 111445550
N-[(1-hydroxycyclobutyl)methyl]naphthalene-2-carboxamide
CID 111445480
6-chloro-N-[(1-hydroxycyclohexyl)methyl]pyridine-3-carboxamide
CID 65107127
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methoxypyridine-3-carboxamide
CID 65120212
2-ethyl-2-[[(6-phenoxypyridine-3-carbonyl)amino]methyl]butanoic acid
CID 120533319
6-phenoxy-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 87000850

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide (CID 111539349) is N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide is O=C(NCC1(O)CCC1)c1ccc(Oc2ccccc2)nc1.
What is the InChIKey of N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide?
The InChIKey is UCNLZIHHSGVSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c20-16(19-12-17(21)9-4-10-17)13-7-8-15(18-11-13)22-14-5-2-1-3-6-14/h1-3,5-8,11,21H,4,9-10,12H2,(H,19,20).
What are the key properties of N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide?
N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide has a molecular weight of 298.34 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 111539349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).