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

C10H17N5O — CID 80821112

IUPAC2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide
SMILESCCCCN(CC(N)=O)c1ccnc(N)n1
InChIInChI=1S/C10H17N5O/c1-2-3-6-15(7-8(11)16)9-4-5-13-10(12)14-9/h4-5H,2-3,6-7H2,1H3,(H2,11,16)(H2,12,13,14)
InChIKeyPZTPAVXPTGNUNK-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.15
Rot. Bonds6

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

2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide (PubChem CID 80821112) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide.

Molecular Properties

Compound Name2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide
PubChem CID80821112
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide
SMILESCCCCN(CC(N)=O)c1ccnc(N)n1
InChIInChI=1S/C10H17N5O/c1-2-3-6-15(7-8(11)16)9-4-5-13-10(12)14-9/h4-5H,2-3,6-7H2,1H3,(H2,11,16)(H2,12,13,14)
InChIKeyPZTPAVXPTGNUNK-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

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Related Compounds

2-[butyl-(2-chloropyrimidin-4-yl)amino]acetamide
CID 62343261
2-[(2-aminopyrimidin-4-yl)-butylamino]ethanol
CID 80808960
2-[butyl-[2-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80821107
2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide
CID 116796582
2-[butyl(pyrimidin-2-yl)amino]acetamide
CID 84590934
2-[(2-aminopyrimidin-4-yl)-ethylamino]-N,N-dimethylacetamide
CID 80809739
4-N-[3-(dimethylamino)propyl]-4-N-ethylpyrimidine-2,4-diamine
CID 102998809
2-[(3-amino-4-cyano-2-pyridinyl)-butylamino]acetamide
CID 82817305
2-[(5-amino-1,3-thiazol-2-yl)-butylamino]acetamide
CID 102768070
2-[butyl-(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]acetamide
CID 80947162
2-[butyl-[5-[(tert-butylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80636665
N-butyl-N-ethyl-2-hydrazinylpyrimidin-4-amine
CID 80918365

Frequently Asked Questions

What is the IUPAC name of 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide?
The IUPAC name of 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide (CID 80821112) is 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide.
What is the SMILES notation for 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide?
The canonical SMILES for 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide is CCCCN(CC(N)=O)c1ccnc(N)n1.
What is the InChIKey of 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide?
The InChIKey is PZTPAVXPTGNUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-2-3-6-15(7-8(11)16)9-4-5-13-10(12)14-9/h4-5H,2-3,6-7H2,1H3,(H2,11,16)(H2,12,13,14).
What are the key properties of 2-[(2-aminopyrimidin-4-yl)-butylamino]acetamide?
2-[(2-aminopyrimidin-4-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-[(2-aminopyrimidin-4-yl)-butylamino]acetamide is sourced from PubChem (CID 80821112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).