3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide

C16H26N4O — CID 122322209

IUPAC3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide
SMILESCc1cc(N(C)C)nc(CNC(=O)CCC2CCCC2)n1
InChIInChI=1S/C16H26N4O/c1-12-10-15(20(2)3)19-14(18-12)11-17-16(21)9-8-13-6-4-5-7-13/h10,13H,4-9,11H2,1-3H3,(H,17,21)
InChIKeyXODNLBPVGMGAPY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.44
Rot. Bonds6

About 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide

3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide (PubChem CID 122322209) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide
PubChem CID122322209
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide
SMILESCc1cc(N(C)C)nc(CNC(=O)CCC2CCCC2)n1
InChIInChI=1S/C16H26N4O/c1-12-10-15(20(2)3)19-14(18-12)11-17-16(21)9-8-13-6-4-5-7-13/h10,13H,4-9,11H2,1-3H3,(H,17,21)
InChIKeyXODNLBPVGMGAPY-UHFFFAOYSA-N
XLogP2.44
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclohexyl-N-[[4-(dimethylamino)pyrimidin-2-yl]methyl]propanamide
CID 121137204
3-cyclopentyl-N-[4-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]propanamide
CID 18566661
3-(3-chlorophenyl)-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide
CID 122322284
N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]adamantane-1-carboxamide
CID 122322210
3-cyclohexyl-N-[[4-(dimethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]methyl]propanamide
CID 122254698
3-(3-chloro-4-fluorophenyl)-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide
CID 122322348
3-cyclohexyl-N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]propanamide
CID 122352211
N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 122322260
2-cyclopentyl-N-[2-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]ethyl]acetamide
CID 122295383
3-[(2R)-1-methylpiperidin-2-yl]-N-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl]propanamide
CID 97210003
N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
CID 122322239
N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]-4-methylthiophene-2-carboxamide
CID 122322257

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide (CID 122322209) is 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide is Cc1cc(N(C)C)nc(CNC(=O)CCC2CCCC2)n1.
What is the InChIKey of 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide?
The InChIKey is XODNLBPVGMGAPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-10-15(20(2)3)19-14(18-12)11-17-16(21)9-8-13-6-4-5-7-13/h10,13H,4-9,11H2,1-3H3,(H,17,21).
What are the key properties of 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide?
3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]methyl]propanamide is sourced from PubChem (CID 122322209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).