2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide

C10H17N5O — CID 116796582

IUPAC2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide
SMILESCCCCN(CC(N)=O)c1nccc(N)n1
InChIInChI=1S/C10H17N5O/c1-2-3-6-15(7-9(12)16)10-13-5-4-8(11)14-10/h4-5H,2-3,6-7H2,1H3,(H2,12,16)(H2,11,13,14)
InChIKeyDASPUEXVBNAPLB-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.15
Rot. Bonds6

About 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide

2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide (PubChem CID 116796582) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide.

Molecular Properties

Compound Name2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide
PubChem CID116796582
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide
SMILESCCCCN(CC(N)=O)c1nccc(N)n1
InChIInChI=1S/C10H17N5O/c1-2-3-6-15(7-9(12)16)10-13-5-4-8(11)14-10/h4-5H,2-3,6-7H2,1H3,(H2,12,16)(H2,11,13,14)
InChIKeyDASPUEXVBNAPLB-UHFFFAOYSA-N
XLogP0.15
TPSA98.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[butyl(pyrimidin-2-yl)amino]acetamide
CID 84590934
2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide
CID 80821112
2-[butyl-(2-chloropyrimidin-4-yl)amino]acetamide
CID 62343261
2-[butyl-[2-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80821107
2-[(3-amino-4-cyano-2-pyridinyl)-butylamino]acetamide
CID 82817305
2-[(5-amino-1,3-thiazol-2-yl)-butylamino]acetamide
CID 102768070
methyl 2-[(4-aminopyrimidin-2-yl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 116796877
2-[[6-(aminomethyl)-3-pyridinyl]-butylamino]acetamide
CID 115486965
2-[[4-(aminomethyl)pyridazin-3-yl]-butylamino]acetamide
CID 80508966
2-[(6-amino-5-methylpyrimidin-4-yl)-butylamino]acetamide
CID 80821350
2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide
CID 107545435
2-[(6-amino-5-ethylpyrimidin-4-yl)-butylamino]acetamide
CID 80821348

Frequently Asked Questions

What is the IUPAC name of 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide?
The IUPAC name of 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide (CID 116796582) is 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide.
What is the SMILES notation for 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide?
The canonical SMILES for 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide is CCCCN(CC(N)=O)c1nccc(N)n1.
What is the InChIKey of 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide?
The InChIKey is DASPUEXVBNAPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-2-3-6-15(7-9(12)16)10-13-5-4-8(11)14-10/h4-5H,2-3,6-7H2,1H3,(H2,12,16)(H2,11,13,14).
What are the key properties of 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide?
2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide has a molecular weight of 223.28 g/mol, XLogP of 0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide is sourced from PubChem (CID 116796582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).