N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide

C19H26N2O2 — CID 18119554

IUPACN-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide
SMILESO=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C1CCCC1
InChIInChI=1S/C19H26N2O2/c22-18(16-6-2-3-7-16)20-14-15-8-10-17(11-9-15)19(23)21-12-4-1-5-13-21/h8-11,16H,1-7,12-14H2,(H,20,22)
InChIKeyITYFHAMIYXBGMO-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.12
Rot. Bonds4

About N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide

N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide (PubChem CID 18119554) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide
PubChem CID18119554
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide
SMILESO=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C1CCCC1
InChIInChI=1S/C19H26N2O2/c22-18(16-6-2-3-7-16)20-14-15-8-10-17(11-9-15)19(23)21-12-4-1-5-13-21/h8-11,16H,1-7,12-14H2,(H,20,22)
InChIKeyITYFHAMIYXBGMO-UHFFFAOYSA-N
XLogP3.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(piperazine-1-carbonyl)phenyl]methyl]cyclohexanecarboxamide
CID 39162933
N-[[4-(4-aminopiperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide;hydrochloride
CID 119375294
(3R)-1-(4-chlorobenzoyl)-N-[(4-chlorophenyl)methyl]piperidine-3-carboxamide
CID 8713114
(2R)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]oxane-2-carboxamide
CID 125158287
2-cyclopentyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]acetamide
CID 18159694
(3R)-N-[[4-(4-methylpiperazine-1-carbonyl)phenyl]methyl]-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 51948137
[4-(piperidine-1-carbonyl)phenyl]methylurea
CID 51073375
(3S,4S)-1-[4-[(cyclopentanecarbonylamino)methyl]benzoyl]-4-methylpyrrolidine-3-carboxylic acid
CID 120952414
3-amino-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119694814
N-[(4-carbamothioylphenyl)methyl]cyclooctanecarboxamide
CID 65018764
1-(4-fluorobenzoyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide
CID 55657080
1-(4-fluorobenzoyl)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide
CID 55454977

Frequently Asked Questions

What is the IUPAC name of N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide?
The IUPAC name of N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide (CID 18119554) is N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide?
The canonical SMILES for N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide is O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C1CCCC1.
What is the InChIKey of N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide?
The InChIKey is ITYFHAMIYXBGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c22-18(16-6-2-3-7-16)20-14-15-8-10-17(11-9-15)19(23)21-12-4-1-5-13-21/h8-11,16H,1-7,12-14H2,(H,20,22).
What are the key properties of N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide?
N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide has a molecular weight of 314.43 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide is sourced from PubChem (CID 18119554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).