CID 43558514

C17H25N2O — CID 43558514

IUPAC—
SMILESCCN(C(=O)CCC1CCC[N]C1)c1ccccc1C
InChIInChI=1S/C17H25N2O/c1-3-19(16-9-5-4-7-14(16)2)17(20)11-10-15-8-6-12-18-13-15/h4-5,7,9,15H,3,6,8,10-13H2,1-2H3
InChIKeyRFPUKUJITBFYBL-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.14
Rot. Bonds5

About CID 43558514

CID 43558514 (PubChem CID 43558514) has the molecular formula C17H25N2O and a molecular weight of 273.40 g/mol.

Molecular Properties

Compound NameCID 43558514
PubChem CID43558514
Molecular FormulaC17H25N2O
Molecular Weight273.40 g/mol
Exact Mass273.20
IUPAC Name—
SMILESCCN(C(=O)CCC1CCC[N]C1)c1ccccc1C
InChIInChI=1S/C17H25N2O/c1-3-19(16-9-5-4-7-14(16)2)17(20)11-10-15-8-6-12-18-13-15/h4-5,7,9,15H,3,6,8,10-13H2,1-2H3
InChIKeyRFPUKUJITBFYBL-UHFFFAOYSA-N
XLogP3.14
TPSA34.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-N-(2-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62210137
CID 43558669
CID 43558669
CID 43558680
CID 43558680
2-(3-aminopiperidin-1-yl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 61297602
2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]-N-ethyl-N-(2-methylphenyl)acetamide
CID 79411167
N-ethyl-3-[(3R)-3-(2-hydroxypropan-2-yl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
CID 124757798
N-ethyl-N-(5-hydroxy-2-methylphenyl)-3-piperidin-3-ylpropanamide
CID 107734491
3-[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-N-ethyl-N-(2-methylphenyl)propanamide
CID 50968149
N-ethyl-2-(3-hydroxyazetidin-1-yl)-N-(2-methylphenyl)acetamide
CID 63282299
2-(2-aminophenyl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 18070776
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-ethyl-N-(2-methylphenyl)propanamide
CID 91835004
2-[ethyl-(2-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103977682

Frequently Asked Questions

What is the IUPAC name of CID 43558514?
The IUPAC name of CID 43558514 (CID 43558514) is not available.
What is the SMILES notation for CID 43558514?
The canonical SMILES for CID 43558514 is CCN(C(=O)CCC1CCC[N]C1)c1ccccc1C.
What is the InChIKey of CID 43558514?
The InChIKey is RFPUKUJITBFYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N2O/c1-3-19(16-9-5-4-7-14(16)2)17(20)11-10-15-8-6-12-18-13-15/h4-5,7,9,15H,3,6,8,10-13H2,1-2H3.
What are the key properties of CID 43558514?
CID 43558514 has a molecular weight of 273.40 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 43558514 is sourced from PubChem (CID 43558514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).