N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide

C12H20N4O — CID 61240529

IUPACN-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide
SMILESCCCNC(=O)CNc1cc(CCC)ncn1
InChIInChI=1S/C12H20N4O/c1-3-5-10-7-11(16-9-15-10)14-8-12(17)13-6-4-2/h7,9H,3-6,8H2,1-2H3,(H,13,17)(H,14,15,16)
InChIKeyAPQGIKOEGVHTDK-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.37
Rot. Bonds7

About N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide

N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide (PubChem CID 61240529) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide
PubChem CID61240529
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide
SMILESCCCNC(=O)CNc1cc(CCC)ncn1
InChIInChI=1S/C12H20N4O/c1-3-5-10-7-11(16-9-15-10)14-8-12(17)13-6-4-2/h7,9H,3-6,8H2,1-2H3,(H,13,17)(H,14,15,16)
InChIKeyAPQGIKOEGVHTDK-UHFFFAOYSA-N
XLogP1.37
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(6-propylpyrimidin-4-yl)amino]acetate
CID 61240139
N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80942500
N-ethyl-N'-(6-propylpyrimidin-4-yl)propane-1,3-diamine
CID 61241880
N-ethyl-2-[(6-methoxypyrimidin-4-yl)amino]acetamide
CID 66327427
2-[(6-ethylpyrimidin-4-yl)amino]acetic acid
CID 61236041
2-[[6-(ethylamino)-2-pyridinyl]amino]-N-propylacetamide
CID 80787440
2-[[6-(ethylamino)pyrazin-2-yl]amino]-N-propylacetamide
CID 78990280
2-[2-[(6-propylpyrimidin-4-yl)amino]ethyl]-1,3-thiazole-4-carboxylic acid
CID 66374330
N-ethyl-2-[[5-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80788303
1-[[(6-propylpyrimidin-4-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115433253
2-[(1-chloroisoquinolin-3-yl)amino]-N-propylacetamide
CID 133383027
N-(2-methylbutyl)-6-propylpyrimidin-4-amine
CID 62694370

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide (CID 61240529) is N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide is CCCNC(=O)CNc1cc(CCC)ncn1.
What is the InChIKey of N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide?
The InChIKey is APQGIKOEGVHTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-5-10-7-11(16-9-15-10)14-8-12(17)13-6-4-2/h7,9H,3-6,8H2,1-2H3,(H,13,17)(H,14,15,16).
What are the key properties of N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide?
N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide has a molecular weight of 236.32 g/mol, XLogP of 1.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-[(6-propylpyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 61240529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).