propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate

C15H18N2O2 — CID 135388422

IUPACpropan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate
SMILESCC(C)OC(=O)N(C)Cc1cccc2ncccc12
InChIInChI=1S/C15H18N2O2/c1-11(2)19-15(18)17(3)10-12-6-4-8-14-13(12)7-5-9-16-14/h4-9,11H,10H2,1-3H3
InChIKeyJWKRQNMQAWWMEO-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.21
Rot. Bonds3

About propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate

propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate (PubChem CID 135388422) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate
PubChem CID135388422
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Namepropan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate
SMILESCC(C)OC(=O)N(C)Cc1cccc2ncccc12
InChIInChI=1S/C15H18N2O2/c1-11(2)19-15(18)17(3)10-12-6-4-8-14-13(12)7-5-9-16-14/h4-9,11H,10H2,1-3H3
InChIKeyJWKRQNMQAWWMEO-UHFFFAOYSA-N
XLogP3.21
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate
CID 177326284
propan-2-yl N-(quinolin-5-ylmethyl)carbamate
CID 135387719
2-(2-methoxyphenyl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 70744785
3-(benzenesulfonyl)-N-methyl-N-(quinolin-5-ylmethyl)propanamide
CID 70709829
(2S)-2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 97188254
N-[2-[methyl(quinolin-5-ylmethyl)amino]-2-oxoethyl]benzamide
CID 70751619
2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 56905403
N-methyl-2-pyrrol-1-yl-N-(quinolin-4-ylmethyl)propanamide
CID 56863740
5-ethoxy-N-methyl-N-(quinolin-5-ylmethyl)-1H-indole-2-carboxamide
CID 46954671
3-(2,5-dimethyl-4-pyridinyl)-1-methyl-1-(quinolin-5-ylmethyl)urea
CID 166362232
3-N-methyl-5-N-(2-methylpropyl)-4-oxo-1-propan-2-yl-3-N-(quinolin-5-ylmethyl)pyridine-3,5-dicarboxamide
CID 28786533
ethane;5-ethylquinoline
CID 143401043

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate?
The IUPAC name of propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate (CID 135388422) is propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate.
What is the SMILES notation for propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate?
The canonical SMILES for propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate is CC(C)OC(=O)N(C)Cc1cccc2ncccc12.
What is the InChIKey of propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate?
The InChIKey is JWKRQNMQAWWMEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-11(2)19-15(18)17(3)10-12-6-4-8-14-13(12)7-5-9-16-14/h4-9,11H,10H2,1-3H3.
What are the key properties of propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate?
propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate has a molecular weight of 258.32 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate is sourced from PubChem (CID 135388422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).