N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide

C12H18N2O — CID 70912611

IUPACN-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide
SMILESCC(=O)N(C)Cc1ccc(C(C)C)cn1
InChIInChI=1S/C12H18N2O/c1-9(2)11-5-6-12(13-7-11)8-14(4)10(3)15/h5-7,9H,8H2,1-4H3
InChIKeyNPZLKSUPEJJFCC-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.18
Rot. Bonds3

About N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide

N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide (PubChem CID 70912611) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide
PubChem CID70912611
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide
SMILESCC(=O)N(C)Cc1ccc(C(C)C)cn1
InChIInChI=1S/C12H18N2O/c1-9(2)11-5-6-12(13-7-11)8-14(4)10(3)15/h5-7,9H,8H2,1-4H3
InChIKeyNPZLKSUPEJJFCC-UHFFFAOYSA-N
XLogP2.18
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-2-(5-propan-2-yl-2-pyridinyl)acetamide
CID 176600306
N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
CID 60631160
N,N-dimethyl-5-propan-2-ylpyridine-2-carboxamide
CID 59186535
(2R)-N-[(5-ethyl-2-pyridinyl)methyl]-2-(4-fluorophenyl)-2-hydroxy-N-methylacetamide
CID 99929265
N-methyl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 58166119
N-[[4-[[acetyl(methyl)amino]methyl]phenyl]methyl]-N-methylacetamide
CID 20593123
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 23402951
N-[(5-ethyl-2-pyridinyl)methyl]-N-methyl-2-propan-2-yloxyacetamide
CID 91766594
4,4,4-trifluoro-1-(5-propan-2-yl-2-pyridinyl)butan-2-ol
CID 137411130
(2R)-2-amino-N-[(5-ethyl-2-pyridinyl)methyl]-N,4-dimethylpentanamide
CID 56873625
ethane;N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 143432699
1-(6-ethyl-3-pyridinyl)-N,N-dimethylethanamine
CID 88977966

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide?
The IUPAC name of N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide (CID 70912611) is N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide.
What is the SMILES notation for N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide?
The canonical SMILES for N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide is CC(=O)N(C)Cc1ccc(C(C)C)cn1.
What is the InChIKey of N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide?
The InChIKey is NPZLKSUPEJJFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9(2)11-5-6-12(13-7-11)8-14(4)10(3)15/h5-7,9H,8H2,1-4H3.
What are the key properties of N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide?
N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide has a molecular weight of 206.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide is sourced from PubChem (CID 70912611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).