N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide

C17H24N2O — CID 112985422

IUPACN-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESCCC1CCCCN1c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C17H24N2O/c1-2-15-5-3-4-12-19(15)16-10-8-14(9-11-16)18-17(20)13-6-7-13/h8-11,13,15H,2-7,12H2,1H3,(H,18,20)
InChIKeyYBOOJMDHAJQQKY-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.80
Rot. Bonds4

About N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide

N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide (PubChem CID 112985422) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide
PubChem CID112985422
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide
SMILESCCC1CCCCN1c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C17H24N2O/c1-2-15-5-3-4-12-19(15)16-10-8-14(9-11-16)18-17(20)13-6-7-13/h8-11,13,15H,2-7,12H2,1H3,(H,18,20)
InChIKeyYBOOJMDHAJQQKY-UHFFFAOYSA-N
XLogP3.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
CID 112985421
N-[4-(2-ethylpiperidin-1-yl)phenyl]thiophene-2-carboxamide
CID 112985429
4-(2-ethylpiperidine-1-carbonyl)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 109150013
N-(4-chlorophenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196262
N-[4-(2-ethylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 112985450
N-[4-(2-ethylpiperidin-1-yl)phenyl]-3-methoxybenzamide
CID 112985435
2-ethyl-1-(4-methylphenyl)piperidine
CID 90712958
N-[4-(2-ethylpiperidin-1-yl)phenyl]-4-(1-methylpyrrole-2-carbonyl)piperazine-1-carboxamide
CID 66584478
N-(4-ethoxyphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196271
1-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-3-phenylurea
CID 113030715
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
5-(2-ethylpiperidin-1-yl)-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109240663

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide (CID 112985422) is N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide is CCC1CCCCN1c1ccc(NC(=O)C2CC2)cc1.
What is the InChIKey of N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide?
The InChIKey is YBOOJMDHAJQQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-15-5-3-4-12-19(15)16-10-8-14(9-11-16)18-17(20)13-6-7-13/h8-11,13,15H,2-7,12H2,1H3,(H,18,20).
What are the key properties of N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide?
N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide has a molecular weight of 272.39 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 112985422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).