propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate

C10H15N3O2 — CID 177326284

IUPACpropan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate
SMILESCC(C)OC(=O)N(C)Cc1ncccn1
InChIInChI=1S/C10H15N3O2/c1-8(2)15-10(14)13(3)7-9-11-5-4-6-12-9/h4-6,8H,7H2,1-3H3
InChIKeyYAYSKUZSSKMJJF-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.45
Rot. Bonds3

About propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate

propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate (PubChem CID 177326284) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate
PubChem CID177326284
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Namepropan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate
SMILESCC(C)OC(=O)N(C)Cc1ncccn1
InChIInChI=1S/C10H15N3O2/c1-8(2)15-10(14)13(3)7-9-11-5-4-6-12-9/h4-6,8H,7H2,1-3H3
InChIKeyYAYSKUZSSKMJJF-UHFFFAOYSA-N
XLogP1.45
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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propan-2-yl 2-pyrimidin-2-ylsulfanylacetate
CID 47095344
4-[methyl(pyrimidin-2-ylmethyl)amino]butanoic acid
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1,1,1-trifluoropropan-2-yl N-methyl-N-[(3-pyridin-3-ylphenyl)methyl]carbamate
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propan-2-yl N-hexyl-N-methylcarbamate
CID 88569732
propan-2-yl formate;1-pyrimidin-2-ylpropan-2-one
CID 171501049
3-[methyl(pyrimidin-2-ylmethyl)amino]butanethioamide
CID 63224147
propan-2-yl N-ethyl-N-pyridin-4-ylcarbamate
CID 106934812
(2,2-dimethyl-1-pyrimidin-2-ylpropyl) carbamate
CID 175600626
N-methyl-2-phenyl-N-(pyrimidin-2-ylmethyl)cyclopentene-1-carboxamide
CID 166263118
1-(6-pyridin-2-yl-1,2,4,5-tetrazin-3-yl)ethyl N-methyl-N-(2-methylpropyl)carbamate
CID 153422568

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate?
The IUPAC name of propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate (CID 177326284) is propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate.
What is the SMILES notation for propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate?
The canonical SMILES for propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate is CC(C)OC(=O)N(C)Cc1ncccn1.
What is the InChIKey of propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate?
The InChIKey is YAYSKUZSSKMJJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(2)15-10(14)13(3)7-9-11-5-4-6-12-9/h4-6,8H,7H2,1-3H3.
What are the key properties of propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate?
propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate has a molecular weight of 209.25 g/mol, XLogP of 1.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-methyl-N-(pyrimidin-2-ylmethyl)carbamate is sourced from PubChem (CID 177326284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).