2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone

C16H18N2O — CID 14590944

IUPAC2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone
SMILESCc1cccc(CN(C)CC(=O)c2ccccc2)n1
InChIInChI=1S/C16H18N2O/c1-13-7-6-10-15(17-13)11-18(2)12-16(19)14-8-4-3-5-9-14/h3-10H,11-12H2,1-2H3
InChIKeySBFKWWIVKDJPHP-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.70
Rot. Bonds5

About 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone

2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone (PubChem CID 14590944) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone.

Molecular Properties

Compound Name2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone
PubChem CID14590944
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone
SMILESCc1cccc(CN(C)CC(=O)c2ccccc2)n1
InChIInChI=1S/C16H18N2O/c1-13-7-6-10-15(17-13)11-18(2)12-16(19)14-8-4-3-5-9-14/h3-10H,11-12H2,1-2H3
InChIKeySBFKWWIVKDJPHP-UHFFFAOYSA-N
XLogP2.70
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

trifluoro-[3-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]prop-1-en-2-yl]boranuide
CID 106746198
N'-hydroxy-2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]ethanimidamide
CID 79267709
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 23402951
ethane;N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 143432699
(Z)-2-ethyl-4-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]but-2-enoic acid
CID 134000503
3-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]benzoic acid
CID 102823192
N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
CID 79267853
CID 131847838
CID 131847838
2-[(6-methyl-2-pyridinyl)methyl-propan-2-ylamino]acetic acid
CID 79261215
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]-1-phenylethanone
CID 62036219
1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
CID 62052783
2,2-dimethyl-3-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-oxopropanoic acid
CID 82820939

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone?
The IUPAC name of 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone (CID 14590944) is 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone.
What is the SMILES notation for 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone?
The canonical SMILES for 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone is Cc1cccc(CN(C)CC(=O)c2ccccc2)n1.
What is the InChIKey of 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone?
The InChIKey is SBFKWWIVKDJPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-13-7-6-10-15(17-13)11-18(2)12-16(19)14-8-4-3-5-9-14/h3-10H,11-12H2,1-2H3.
What are the key properties of 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone?
2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone has a molecular weight of 254.33 g/mol, XLogP of 2.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone is sourced from PubChem (CID 14590944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).