N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide

C20H24N2O3 — CID 47041805

IUPACN-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(C)nc2)ccc1OC1CCCC1
InChIInChI=1S/C20H24N2O3/c1-14-7-9-16(13-21-14)20(23)22-12-15-8-10-18(19(11-15)24-2)25-17-5-3-4-6-17/h7-11,13,17H,3-6,12H2,1-2H3,(H,22,23)
InChIKeyTUWUMAQHOCEFER-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.65
Rot. Bonds6

About N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide

N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide (PubChem CID 47041805) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
PubChem CID47041805
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(C)nc2)ccc1OC1CCCC1
InChIInChI=1S/C20H24N2O3/c1-14-7-9-16(13-21-14)20(23)22-12-15-8-10-18(19(11-15)24-2)25-17-5-3-4-6-17/h7-11,13,17H,3-6,12H2,1-2H3,(H,22,23)
InChIKeyTUWUMAQHOCEFER-UHFFFAOYSA-N
XLogP3.65
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]hydroxylamine
CID 115004271
3-amino-N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119774714
3-cyclopentyloxy-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-methoxybenzamide
CID 75503642
5-amino-N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-2-methylbenzamide
CID 120630970
ethane;methyl 4-cyclopentyloxy-3-methoxybenzoate
CID 144796199
3-cyclopentyloxy-N-(1H-imidazol-2-ylmethyl)-4-methoxybenzamide
CID 75520735
N-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3,4-diethoxybenzamide
CID 60520618
N-[(3,4-dimethoxyphenyl)methyl]-4-sulfanylbenzamide
CID 107023018
N-[(1R,6S,7S,8R)-8-(3,4-dimethoxyphenyl)-7-bicyclo[4.2.0]octanyl]-6-methylpyridine-3-carboxamide
CID 92558886
N-[4-[2-(3-cyclopentyloxy-4-methoxyphenyl)ethylcarbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 142662106
N-[(1-ethylpyrazol-4-yl)methyl]-3-methoxy-4-(1-methylpiperidin-4-yl)oxybenzamide
CID 25482785
4-cyclopentyloxy-3-methoxy-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 47065905

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide (CID 47041805) is N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide is COc1cc(CNC(=O)c2ccc(C)nc2)ccc1OC1CCCC1.
What is the InChIKey of N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
The InChIKey is TUWUMAQHOCEFER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14-7-9-16(13-21-14)20(23)22-12-15-8-10-18(19(11-15)24-2)25-17-5-3-4-6-17/h7-11,13,17H,3-6,12H2,1-2H3,(H,22,23).
What are the key properties of N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide?
N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclopentyloxy-3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 47041805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).