2-(cycloheptylamino)-2-phenylpropanamide

C16H24N2O — CID 54892648

IUPAC2-(cycloheptylamino)-2-phenylpropanamide
SMILESCC(NC1CCCCCC1)(C(N)=O)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-16(15(17)19,13-9-5-4-6-10-13)18-14-11-7-2-3-8-12-14/h4-6,9-10,14,18H,2-3,7-8,11-12H2,1H3,(H2,17,19)
InChIKeyMPKNEXHZYMWVMT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.70
Rot. Bonds4

About 2-(cycloheptylamino)-2-phenylpropanamide

2-(cycloheptylamino)-2-phenylpropanamide (PubChem CID 54892648) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(cycloheptylamino)-2-phenylpropanamide.

Molecular Properties

Compound Name2-(cycloheptylamino)-2-phenylpropanamide
PubChem CID54892648
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(cycloheptylamino)-2-phenylpropanamide
SMILESCC(NC1CCCCCC1)(C(N)=O)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-16(15(17)19,13-9-5-4-6-10-13)18-14-11-7-2-3-8-12-14/h4-6,9-10,14,18H,2-3,7-8,11-12H2,1H3,(H2,17,19)
InChIKeyMPKNEXHZYMWVMT-UHFFFAOYSA-N
XLogP2.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopentylamino)-2-(4-hydroxyphenyl)propanamide
CID 54894194
2-(cyclopentylamino)-2-(3-hydroxyphenyl)propanamide
CID 54894241
2-(3-bromophenyl)-2-(cyclopentylamino)propanamide
CID 54893904
2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
CID 60795288
2-(cyclohexylamino)-2-(3,5-dihydroxyphenyl)propanamide
CID 107707551
ethyl 2-(cyclopentylamino)-2-phenylpropanoate
CID 54893875
2-(cyclopentylamino)-2-(4-ethoxyphenyl)propanamide
CID 60999099
2-(cyclopropylamino)-2-pyridin-4-ylpropanamide
CID 60795921
2-(cyclopentylamino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
CID 60998760
2-(cyclopentylamino)-3-methoxy-2-phenylpropanamide
CID 103464910
2-(cycloheptylamino)-2-(4-methylsulfanylphenyl)propanoic acid
CID 60997964
2-(cycloheptylamino)-2-(2,4-difluorophenyl)propanamide
CID 60997602

Frequently Asked Questions

What is the IUPAC name of 2-(cycloheptylamino)-2-phenylpropanamide?
The IUPAC name of 2-(cycloheptylamino)-2-phenylpropanamide (CID 54892648) is 2-(cycloheptylamino)-2-phenylpropanamide.
What is the SMILES notation for 2-(cycloheptylamino)-2-phenylpropanamide?
The canonical SMILES for 2-(cycloheptylamino)-2-phenylpropanamide is CC(NC1CCCCCC1)(C(N)=O)c1ccccc1.
What is the InChIKey of 2-(cycloheptylamino)-2-phenylpropanamide?
The InChIKey is MPKNEXHZYMWVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(15(17)19,13-9-5-4-6-10-13)18-14-11-7-2-3-8-12-14/h4-6,9-10,14,18H,2-3,7-8,11-12H2,1H3,(H2,17,19).
What are the key properties of 2-(cycloheptylamino)-2-phenylpropanamide?
2-(cycloheptylamino)-2-phenylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cycloheptylamino)-2-phenylpropanamide is sourced from PubChem (CID 54892648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).