N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide

C11H18N4O2 — CID 112636787

IUPACN-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nccc(OC(C)C)n1
InChIInChI=1S/C11H18N4O2/c1-4-12-9(16)7-14-11-13-6-5-10(15-11)17-8(2)3/h5-6,8H,4,7H2,1-3H3,(H,12,16)(H,13,14,15)
InChIKeyMHMJDWDLIICHJB-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.81
Rot. Bonds6

About N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide

N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide (PubChem CID 112636787) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide
PubChem CID112636787
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC NameN-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nccc(OC(C)C)n1
InChIInChI=1S/C11H18N4O2/c1-4-12-9(16)7-14-11-13-6-5-10(15-11)17-8(2)3/h5-6,8H,4,7H2,1-3H3,(H,12,16)(H,13,14,15)
InChIKeyMHMJDWDLIICHJB-UHFFFAOYSA-N
XLogP0.81
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)amino]acetamide
CID 112636791
4-propan-2-yloxy-N-propylpyrimidin-2-amine
CID 80860726
2-methyl-3-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanoic acid
CID 112636067
3-[[(4-propan-2-yloxypyrimidin-2-yl)amino]methyl]pentanoic acid
CID 112636210
N-ethyl-2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]acetamide
CID 60732159
2-[(4-propan-2-yloxypyrimidin-2-yl)amino]pentanoic acid
CID 112635985
6-[(4-propan-2-yloxypyrimidin-2-yl)amino]hexanoic acid
CID 112635945
N-(2-methoxyethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112636373
4-propan-2-yloxy-N-prop-2-enylpyrimidin-2-amine
CID 112637442
2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide
CID 112637058
N-tert-butyl-2-[(4-ethoxypyrimidin-2-yl)amino]acetamide
CID 112638339
3-methoxy-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanoic acid
CID 112636213

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide (CID 112636787) is N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide is CCNC(=O)CNc1nccc(OC(C)C)n1.
What is the InChIKey of N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide?
The InChIKey is MHMJDWDLIICHJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-4-12-9(16)7-14-11-13-6-5-10(15-11)17-8(2)3/h5-6,8H,4,7H2,1-3H3,(H,12,16)(H,13,14,15).
What are the key properties of N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide?
N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 112636787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).