2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide

C13H20N4O — CID 54901558

IUPAC2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
SMILESCc1nccc(CNC(=O)CNC2CCCC2)n1
InChIInChI=1S/C13H20N4O/c1-10-14-7-6-12(17-10)8-16-13(18)9-15-11-4-2-3-5-11/h6-7,11,15H,2-5,8-9H2,1H3,(H,16,18)
InChIKeyGUFZSLOYJZYGKW-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.93
Rot. Bonds5

About 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide

2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide (PubChem CID 54901558) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
PubChem CID54901558
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
SMILESCc1nccc(CNC(=O)CNC2CCCC2)n1
InChIInChI=1S/C13H20N4O/c1-10-14-7-6-12(17-10)8-16-13(18)9-15-11-4-2-3-5-11/h6-7,11,15H,2-5,8-9H2,1H3,(H,16,18)
InChIKeyGUFZSLOYJZYGKW-UHFFFAOYSA-N
XLogP0.93
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methylpyrimidin-4-yl)methyl]cyclohexanamine
CID 60962032
N-[(2-methylpyrimidin-4-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 61016997
2-methyl-N-[(2-methylpyrimidin-4-yl)methyl]piperidine-1-carboxamide
CID 47328498
2-(cyclopropylamino)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 62306837
N-[(2-methylpyrimidin-4-yl)methyl]-2-piperidin-4-ylacetamide
CID 54910978
3-chloro-N-[(2-methylpyrimidin-4-yl)methyl]propanamide
CID 61016398
2-(1-aminocyclopentyl)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
CID 64678565
2-(cyclohexylamino)-N-[(4-methylphenyl)methyl]acetamide
CID 108993564
1-cyclohexyl-N-[(2-methylpyrimidin-4-yl)methyl]methanamine
CID 60961240
N-benzyl-2-(cyclopentylamino)acetamide
CID 43084459
2-methyl-3-[(2-methylpyrimidin-4-yl)methylamino]-3-oxopropanoic acid
CID 114897739
trans-(1R,2R)-2-[(2-methylpyrimidin-4-yl)methylamino]cyclopentan-1-ol
CID 93444311

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide?
The IUPAC name of 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide (CID 54901558) is 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide?
The canonical SMILES for 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide is Cc1nccc(CNC(=O)CNC2CCCC2)n1.
What is the InChIKey of 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide?
The InChIKey is GUFZSLOYJZYGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-10-14-7-6-12(17-10)8-16-13(18)9-15-11-4-2-3-5-11/h6-7,11,15H,2-5,8-9H2,1H3,(H,16,18).
What are the key properties of 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide?
2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide is sourced from PubChem (CID 54901558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).