N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide

C17H19N3O — CID 118791325

IUPACN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1cccnc1C(NC(=O)Cc1cccnc1)C1CC1
InChIInChI=1S/C17H19N3O/c1-12-4-2-9-19-16(12)17(14-6-7-14)20-15(21)10-13-5-3-8-18-11-13/h2-5,8-9,11,14,17H,6-7,10H2,1H3,(H,20,21)
InChIKeyMDCCKDPPUSYYIJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.60
Rot. Bonds5

About N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide

N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide (PubChem CID 118791325) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide
PubChem CID118791325
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1cccnc1C(NC(=O)Cc1cccnc1)C1CC1
InChIInChI=1S/C17H19N3O/c1-12-4-2-9-19-16(12)17(14-6-7-14)20-15(21)10-13-5-3-8-18-11-13/h2-5,8-9,11,14,17H,6-7,10H2,1H3,(H,20,21)
InChIKeyMDCCKDPPUSYYIJ-UHFFFAOYSA-N
XLogP2.60
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-phenoxypropanamide
CID 125163176
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyrrol-1-ylacetamide
CID 125171906
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-4-pyrazol-1-ylbutanamide
CID 125160409
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-3-methoxy-2,2-dimethylpropanamide
CID 122569055
N-[(R)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 125165962
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-methoxy-6-methylbenzamide
CID 118778909
N-(1-hydroxypropan-2-yl)-2-pyridin-3-ylacetamide
CID 62691061
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-(methylamino)-1,3-thiazole-4-carboxamide
CID 122563544
N-[(3-hydroxycyclobutyl)-thiophen-2-ylmethyl]-2-pyridin-3-ylacetamide
CID 91764411
N-(4-hydroxybutan-2-yl)-2-pyridin-3-ylacetamide
CID 115283484
3-amino-3-[(2-pyridin-3-ylacetyl)amino]propanoic acid
CID 67329500
2-phenyl-N-[(R)-pyridin-2-yl-[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]methyl]acetamide
CID 92574472

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide (CID 118791325) is N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide is Cc1cccnc1C(NC(=O)Cc1cccnc1)C1CC1.
What is the InChIKey of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide?
The InChIKey is MDCCKDPPUSYYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-12-4-2-9-19-16(12)17(14-6-7-14)20-15(21)10-13-5-3-8-18-11-13/h2-5,8-9,11,14,17H,6-7,10H2,1H3,(H,20,21).
What are the key properties of N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide?
N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide has a molecular weight of 281.36 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(3-methyl-2-pyridinyl)methyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 118791325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).