5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide

C7H12N4O2 — CID 142719201

IUPAC5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide
SMILESNC1=CN(C(=O)NCCO)CN=C1
InChIInChI=1S/C7H12N4O2/c8-6-3-9-5-11(4-6)7(13)10-1-2-12/h3-4,12H,1-2,5,8H2,(H,10,13)
InChIKeyASDMXYUOXSFEBA-UHFFFAOYSA-N
MW184.20 g/mol
LogP-1.17
Rot. Bonds2

About 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide

5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide (PubChem CID 142719201) has the molecular formula C7H12N4O2 and a molecular weight of 184.20 g/mol. Its IUPAC name is 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide
PubChem CID142719201
Molecular FormulaC7H12N4O2
Molecular Weight184.20 g/mol
Exact Mass184.10
IUPAC Name5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide
SMILESNC1=CN(C(=O)NCCO)CN=C1
InChIInChI=1S/C7H12N4O2/c8-6-3-9-5-11(4-6)7(13)10-1-2-12/h3-4,12H,1-2,5,8H2,(H,10,13)
InChIKeyASDMXYUOXSFEBA-UHFFFAOYSA-N
XLogP-1.17
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide
CID 158640583
[2-(3-Hydroxyazetidin-1-yl)-1,2-dihydropyrimidin-5-yl]urea
CID 170581155

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide?
The IUPAC name of 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide (CID 142719201) is 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide.
What is the SMILES notation for 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide?
The canonical SMILES for 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide is NC1=CN(C(=O)NCCO)CN=C1.
What is the InChIKey of 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide?
The InChIKey is ASDMXYUOXSFEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O2/c8-6-3-9-5-11(4-6)7(13)10-1-2-12/h3-4,12H,1-2,5,8H2,(H,10,13).
What are the key properties of 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide?
5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide has a molecular weight of 184.20 g/mol, XLogP of -1.17, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-hydroxyethyl)-2H-pyrimidine-1-carboxamide is sourced from PubChem (CID 142719201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).