2-(pyrimidin-4-ylmethylamino)acetamide

C7H10N4O — CID 62758549

IUPAC2-(pyrimidin-4-ylmethylamino)acetamide
SMILESNC(=O)CNCc1ccncn1
InChIInChI=1S/C7H10N4O/c8-7(12)4-10-3-6-1-2-9-5-11-6/h1-2,5,10H,3-4H2,(H2,8,12)
InChIKeyJGFAMWFZHWPAAS-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.95
Rot. Bonds4

About 2-(pyrimidin-4-ylmethylamino)acetamide

2-(pyrimidin-4-ylmethylamino)acetamide (PubChem CID 62758549) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-(pyrimidin-4-ylmethylamino)acetamide.

Molecular Properties

Compound Name2-(pyrimidin-4-ylmethylamino)acetamide
PubChem CID62758549
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC Name2-(pyrimidin-4-ylmethylamino)acetamide
SMILESNC(=O)CNCc1ccncn1
InChIInChI=1S/C7H10N4O/c8-7(12)4-10-3-6-1-2-9-5-11-6/h1-2,5,10H,3-4H2,(H2,8,12)
InChIKeyJGFAMWFZHWPAAS-UHFFFAOYSA-N
XLogP-0.95
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(pyrimidin-4-ylmethylamino)butanoic acid
CID 62747116
N-(pyrimidin-4-ylmethyl)prop-2-en-1-amine
CID 62758916
2-pyrimidin-4-ylacetohydrazide
CID 156821377
1-cyclopentyl-N-(pyrimidin-4-ylmethyl)methanamine
CID 62760594
N-cyclopropyl-3-(pyrimidin-4-ylmethylamino)propanamide
CID 79385382
2-(4-aminophenyl)-N-(pyrimidin-4-ylmethyl)acetamide
CID 114110299
2-(1,2-thiazol-3-ylmethylamino)acetamide
CID 82412089
N-[(2-ethylphenyl)methyl]-1-pyrimidin-4-ylmethanamine
CID 64680497
ethyl 2-(pyrimidin-4-ylmethylamino)propanoate
CID 62749095
tert-butyl N-(pyrimidin-4-ylmethylamino)carbamate
CID 107236805
1-amino-3-pyrimidin-4-ylpropan-2-one
CID 177333601
4-(pyrimidin-4-ylmethylamino)benzoic acid
CID 55210671

Frequently Asked Questions

What is the IUPAC name of 2-(pyrimidin-4-ylmethylamino)acetamide?
The IUPAC name of 2-(pyrimidin-4-ylmethylamino)acetamide (CID 62758549) is 2-(pyrimidin-4-ylmethylamino)acetamide.
What is the SMILES notation for 2-(pyrimidin-4-ylmethylamino)acetamide?
The canonical SMILES for 2-(pyrimidin-4-ylmethylamino)acetamide is NC(=O)CNCc1ccncn1.
What is the InChIKey of 2-(pyrimidin-4-ylmethylamino)acetamide?
The InChIKey is JGFAMWFZHWPAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c8-7(12)4-10-3-6-1-2-9-5-11-6/h1-2,5,10H,3-4H2,(H2,8,12).
What are the key properties of 2-(pyrimidin-4-ylmethylamino)acetamide?
2-(pyrimidin-4-ylmethylamino)acetamide has a molecular weight of 166.18 g/mol, XLogP of -0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrimidin-4-ylmethylamino)acetamide is sourced from PubChem (CID 62758549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).