3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide

C6H11N3O — CID 141358739

IUPAC3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide
SMILESCN1C=CCNC1C(N)=O
InChIInChI=1S/C6H11N3O/c1-9-4-2-3-8-6(9)5(7)10/h2,4,6,8H,3H2,1H3,(H2,7,10)
InChIKeyMYWTXNNHXKGMGP-UHFFFAOYSA-N
MW141.17 g/mol
LogP-1.15
Rot. Bonds1

About 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide

3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide (PubChem CID 141358739) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide
PubChem CID141358739
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide
SMILESCN1C=CCNC1C(N)=O
InChIInChI=1S/C6H11N3O/c1-9-4-2-3-8-6(9)5(7)10/h2,4,6,8H,3H2,1H3,(H2,7,10)
InChIKeyMYWTXNNHXKGMGP-UHFFFAOYSA-N
XLogP-1.15
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide?
The IUPAC name of 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide (CID 141358739) is 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide.
What is the SMILES notation for 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide?
The canonical SMILES for 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide is CN1C=CCNC1C(N)=O.
What is the InChIKey of 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide?
The InChIKey is MYWTXNNHXKGMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-9-4-2-3-8-6(9)5(7)10/h2,4,6,8H,3H2,1H3,(H2,7,10).
What are the key properties of 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide?
3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide has a molecular weight of 141.17 g/mol, XLogP of -1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,6-dihydro-1H-pyrimidine-2-carboxamide is sourced from PubChem (CID 141358739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).