N-ethyl-1,2-dihydropyrimidine-2-carboxamide

C7H11N3O — CID 151565733

IUPACN-ethyl-1,2-dihydropyrimidine-2-carboxamide
SMILESCCNC(=O)C1N=CC=CN1
InChIInChI=1S/C7H11N3O/c1-2-8-7(11)6-9-4-3-5-10-6/h3-6,9H,2H2,1H3,(H,8,11)
InChIKeyQDJWWLQHMTYAAU-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.36
Rot. Bonds2

About N-ethyl-1,2-dihydropyrimidine-2-carboxamide

N-ethyl-1,2-dihydropyrimidine-2-carboxamide (PubChem CID 151565733) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is N-ethyl-1,2-dihydropyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1,2-dihydropyrimidine-2-carboxamide
PubChem CID151565733
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC NameN-ethyl-1,2-dihydropyrimidine-2-carboxamide
SMILESCCNC(=O)C1N=CC=CN1
InChIInChI=1S/C7H11N3O/c1-2-8-7(11)6-9-4-3-5-10-6/h3-6,9H,2H2,1H3,(H,8,11)
InChIKeyQDJWWLQHMTYAAU-UHFFFAOYSA-N
XLogP-0.36
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-prop-2-enylideneacetamide
CID 165430636
2-(2-oxopyrimidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
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2H-pyrimidinecarboxamide
CID 22318737
2-(2H-pyrimidin-1-yl)acetamide
CID 22747793
2-(2-Oxopyrimidin-1-yl)acetamide
CID 43350582
2-(2-oxopyrimidin-1-yl)-N-propan-2-ylacetamide
CID 60758847
2-amino-1H-pyrimidine-2-carboxamide
CID 67854524
2H-pyrimidinecarboxamide chloride
CID 86742628
7-Methyl-8,9a-dihydropyrazino[1,2-a]pyrimidin-9-one
CID 89304798
2-methyl-1H-pyrimidine-2-carboxamide
CID 140047876
N-methyl-2-(2-methyl-1,4-diazepin-1-yl)acetamide
CID 141144618
2H-pyrimidine-1,2-dicarboxamide
CID 141442073

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,2-dihydropyrimidine-2-carboxamide?
The IUPAC name of N-ethyl-1,2-dihydropyrimidine-2-carboxamide (CID 151565733) is N-ethyl-1,2-dihydropyrimidine-2-carboxamide.
What is the SMILES notation for N-ethyl-1,2-dihydropyrimidine-2-carboxamide?
The canonical SMILES for N-ethyl-1,2-dihydropyrimidine-2-carboxamide is CCNC(=O)C1N=CC=CN1.
What is the InChIKey of N-ethyl-1,2-dihydropyrimidine-2-carboxamide?
The InChIKey is QDJWWLQHMTYAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-8-7(11)6-9-4-3-5-10-6/h3-6,9H,2H2,1H3,(H,8,11).
What are the key properties of N-ethyl-1,2-dihydropyrimidine-2-carboxamide?
N-ethyl-1,2-dihydropyrimidine-2-carboxamide has a molecular weight of 153.19 g/mol, XLogP of -0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,2-dihydropyrimidine-2-carboxamide is sourced from PubChem (CID 151565733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).