phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate

C15H16N2O2 — CID 60681158

IUPACphenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate
SMILESCN(CCc1ccccn1)C(=O)Oc1ccccc1
InChIInChI=1S/C15H16N2O2/c1-17(12-10-13-7-5-6-11-16-13)15(18)19-14-8-3-2-4-9-14/h2-9,11H,10,12H2,1H3
InChIKeyQRDKKORONTVPEX-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.75
Rot. Bonds4

About phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate

phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate (PubChem CID 60681158) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate.

Molecular Properties

Compound Namephenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate
PubChem CID60681158
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Namephenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate
SMILESCN(CCc1ccccn1)C(=O)Oc1ccccc1
InChIInChI=1S/C15H16N2O2/c1-17(12-10-13-7-5-6-11-16-13)15(18)19-14-8-3-2-4-9-14/h2-9,11H,10,12H2,1H3
InChIKeyQRDKKORONTVPEX-UHFFFAOYSA-N
XLogP2.75
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
CID 78796251
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
methyl(2-pyridin-2-ylethyl)carbamodithioic acid
CID 88510653
4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
2-bromo-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 116816951
N-methyl-2-pyridin-2-yl-N-(pyridin-2-ylmethyl)ethanamine;oxalic acid
CID 2845946
N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172839
2-[methyl(2-pyridin-2-ylethyl)amino]-1-phenylpropan-1-one
CID 43228048
phenyl N-(1H-imidazol-2-ylmethyl)-N-methylcarbamate
CID 63939472
2-(3-acetylphenoxy)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 134017563
ethane;N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172838

Frequently Asked Questions

What is the IUPAC name of phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate?
The IUPAC name of phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate (CID 60681158) is phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate.
What is the SMILES notation for phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate?
The canonical SMILES for phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate is CN(CCc1ccccn1)C(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate?
The InChIKey is QRDKKORONTVPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-17(12-10-13-7-5-6-11-16-13)15(18)19-14-8-3-2-4-9-14/h2-9,11H,10,12H2,1H3.
What are the key properties of phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate?
phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate has a molecular weight of 256.31 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate is sourced from PubChem (CID 60681158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).