N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide

C17H21N5O2 — CID 136759903

IUPACN-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCCN(c2ccc(-c3nc(C)cc(=O)[nH]3)cn2)C1
InChIInChI=1S/C17H21N5O2/c1-11-8-16(24)21-17(19-11)13-5-6-15(18-9-13)22-7-3-4-14(10-22)20-12(2)23/h5-6,8-9,14H,3-4,7,10H2,1-2H3,(H,20,23)(H,19,21,24)/t14-/m1/s1
InChIKeyIOHIVSQOZWOJIO-CQSZACIVSA-N
MW327.39 g/mol
LogP1.25
Rot. Bonds3

About N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide

N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide (PubChem CID 136759903) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide
PubChem CID136759903
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC NameN-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCCN(c2ccc(-c3nc(C)cc(=O)[nH]3)cn2)C1
InChIInChI=1S/C17H21N5O2/c1-11-8-16(24)21-17(19-11)13-5-6-15(18-9-13)22-7-3-4-14(10-22)20-12(2)23/h5-6,8-9,14H,3-4,7,10H2,1-2H3,(H,20,23)(H,19,21,24)/t14-/m1/s1
InChIKeyIOHIVSQOZWOJIO-CQSZACIVSA-N
XLogP1.25
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide with MolForge

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Related Compounds

N-[1-[5-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]-2-methylpropanamide
CID 137263125
4-ethyl-2-[6-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]-1H-pyrimidin-6-one
CID 137268715
N-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]acetamide
CID 47282597
N-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]acetamide
CID 171327953
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
N-[1-[5-[4-methyl-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]-2-pyridinyl]-2-pyridinyl]piperidin-3-yl]acetamide
CID 119098943
4-ethyl-2-[6-[3-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrimidin-6-one
CID 137257680
1-[5-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]pyrrolidine-2-carboxylic acid
CID 137061301
N-[1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]piperidin-3-yl]acetamide
CID 70671781
N-[1-(1-methylpyrazol-3-yl)piperidin-3-yl]acetamide
CID 145270654
2-[6-(4,4-dimethylazepan-1-yl)-3-pyridinyl]-4-ethyl-1H-pyrimidin-6-one
CID 137275494
N-[1-(6-bromo-5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-3-yl]acetamide
CID 171335810

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide?
The IUPAC name of N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide (CID 136759903) is N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide is CC(=O)N[C@@H]1CCCN(c2ccc(-c3nc(C)cc(=O)[nH]3)cn2)C1.
What is the InChIKey of N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide?
The InChIKey is IOHIVSQOZWOJIO-CQSZACIVSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-11-8-16(24)21-17(19-11)13-5-6-15(18-9-13)22-7-3-4-14(10-22)20-12(2)23/h5-6,8-9,14H,3-4,7,10H2,1-2H3,(H,20,23)(H,19,21,24)/t14-/m1/s1.
What are the key properties of N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide?
N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide has a molecular weight of 327.39 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-[5-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]piperidin-3-yl]acetamide is sourced from PubChem (CID 136759903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).