2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide

C12H15FN2O — CID 28566886

IUPAC2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNCC1CC1)Nc1cccc(F)c1
InChIInChI=1S/C12H15FN2O/c13-10-2-1-3-11(6-10)15-12(16)8-14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H,15,16)
InChIKeyIMTRTBRQQSOHBV-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.76
Rot. Bonds5

About 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide

2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide (PubChem CID 28566886) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
PubChem CID28566886
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNCC1CC1)Nc1cccc(F)c1
InChIInChI=1S/C12H15FN2O/c13-10-2-1-3-11(6-10)15-12(16)8-14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H,15,16)
InChIKeyIMTRTBRQQSOHBV-UHFFFAOYSA-N
XLogP1.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclobutylmethylamino)-N-(3-fluorophenyl)acetamide
CID 43298672
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide
CID 119740426
2-(cyclopropylmethylamino)-N-[3-(difluoromethyl)phenyl]acetamide;hydrochloride
CID 119767750
2-(cyclopropylmethylamino)-N-[3-fluoro-4-[(3-fluorophenyl)methoxy]phenyl]acetamide
CID 119773636
2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide
CID 60972732
N-[2-[[2-(3-fluoroanilino)-2-oxoethyl]amino]ethyl]cyclopropanecarboxamide
CID 115571346
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 60928462
N-(3-bromophenyl)-2-[(4-hydroxycyclohexyl)methylamino]acetamide
CID 106133334
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-fluorophenyl)acetamide;hydrochloride
CID 119928163
2-(cyclopropylmethylamino)-N-(4-fluoro-3-methylphenyl)acetamide;hydrochloride
CID 119707226
3-[3-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]propanoic acid
CID 115339894
2-(cyclopropylmethylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
CID 119758034

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide (CID 28566886) is 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide is O=C(CNCC1CC1)Nc1cccc(F)c1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide?
The InChIKey is IMTRTBRQQSOHBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c13-10-2-1-3-11(6-10)15-12(16)8-14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H,15,16).
What are the key properties of 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide?
2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide has a molecular weight of 222.26 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 28566886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).