3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide

C17H20N4O2 — CID 119753519

IUPAC3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide
SMILESCc1cc(Oc2ncccn2)ccc1NC(=O)C1CCC(N)C1
InChIInChI=1S/C17H20N4O2/c1-11-9-14(23-17-19-7-2-8-20-17)5-6-15(11)21-16(22)12-3-4-13(18)10-12/h2,5-9,12-13H,3-4,10,18H2,1H3,(H,21,22)
InChIKeyCFQLIDAWGVGXSE-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.64
Rot. Bonds4

About 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide

3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide (PubChem CID 119753519) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide
PubChem CID119753519
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide
SMILESCc1cc(Oc2ncccn2)ccc1NC(=O)C1CCC(N)C1
InChIInChI=1S/C17H20N4O2/c1-11-9-14(23-17-19-7-2-8-20-17)5-6-15(11)21-16(22)12-3-4-13(18)10-12/h2,5-9,12-13H,3-4,10,18H2,1H3,(H,21,22)
InChIKeyCFQLIDAWGVGXSE-UHFFFAOYSA-N
XLogP2.64
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 48666589
3-amino-N-(4-butoxy-2-methylphenyl)cyclopentane-1-carboxamide
CID 119739406
4-amino-N-(4-ethoxy-2-methylphenyl)cyclohexane-1-carboxamide
CID 60928404
1-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 119753507
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)acetamide
CID 119753531
3-amino-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119849038
2-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)thiophene-2,5-dicarboxamide
CID 71934170
3-amino-N-(4,5-dimethoxy-2-methylphenyl)cyclopentane-1-carboxamide
CID 66009354
3-amino-N-(2,5-dimethylphenyl)cyclopentane-1-carboxamide
CID 66030675
N-(2-methyl-4-pyrimidin-2-yloxyphenyl)-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 60589795
1-[(1R)-cyclohex-2-en-1-yl]-3-(2-methyl-4-pyrimidin-2-yloxyphenyl)urea
CID 97224040
3-amino-N-(2-bromo-5-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119752414

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide (CID 119753519) is 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide is Cc1cc(Oc2ncccn2)ccc1NC(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide?
The InChIKey is CFQLIDAWGVGXSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-11-9-14(23-17-19-7-2-8-20-17)5-6-15(11)21-16(22)12-3-4-13(18)10-12/h2,5-9,12-13H,3-4,10,18H2,1H3,(H,21,22).
What are the key properties of 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide?
3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119753519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).