N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide

C19H24N4O2 — CID 75394886

IUPACN-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NC2CCN(c3ncc(C)c(C)n3)CC2)c1
InChIInChI=1S/C19H24N4O2/c1-13-12-20-19(21-14(13)2)23-9-7-16(8-10-23)22-18(24)15-5-4-6-17(11-15)25-3/h4-6,11-12,16H,7-10H2,1-3H3,(H,22,24)
InChIKeyQFBNXZDDUFMYCY-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.50
Rot. Bonds4

About N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide

N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide (PubChem CID 75394886) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide
PubChem CID75394886
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NC2CCN(c3ncc(C)c(C)n3)CC2)c1
InChIInChI=1S/C19H24N4O2/c1-13-12-20-19(21-14(13)2)23-9-7-16(8-10-23)22-18(24)15-5-4-6-17(11-15)25-3/h4-6,11-12,16H,7-10H2,1-3H3,(H,22,24)
InChIKeyQFBNXZDDUFMYCY-UHFFFAOYSA-N
XLogP2.50
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-N-[1-(2-methylpyrimidin-4-yl)piperidin-4-yl]benzamide
CID 75494317
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-methoxy-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]benzamide
CID 99697550
3-methoxy-N-[1-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-4-yl]benzamide
CID 75528323
3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
CID 108550302
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3-methoxybenzamide
CID 110819864
3-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]benzamide
CID 71784695
N-[1-(5-bromo-4-methoxypyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175649555
3-methoxy-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 47029925
3-methoxy-N-[1-(5-phenyl-1H-pyrazol-3-yl)piperidin-4-yl]benzamide
CID 75528481
N-[1-(7-chloroquinolin-4-yl)piperidin-4-yl]-3-methoxybenzamide
CID 24830372
N-[1-[1-(cyclopropylmethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-3-methoxybenzamide
CID 91911835

Frequently Asked Questions

What is the IUPAC name of N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide?
The IUPAC name of N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide (CID 75394886) is N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide.
What is the SMILES notation for N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide?
The canonical SMILES for N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide is COc1cccc(C(=O)NC2CCN(c3ncc(C)c(C)n3)CC2)c1.
What is the InChIKey of N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide?
The InChIKey is QFBNXZDDUFMYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-12-20-19(21-14(13)2)23-9-7-16(8-10-23)22-18(24)15-5-4-6-17(11-15)25-3/h4-6,11-12,16H,7-10H2,1-3H3,(H,22,24).
What are the key properties of N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide?
N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide has a molecular weight of 340.43 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4,5-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-methoxybenzamide is sourced from PubChem (CID 75394886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).