[4-(piperidine-1-carbonyl)phenyl]methylurea

C14H19N3O2 — CID 51073375

IUPAC[4-(piperidine-1-carbonyl)phenyl]methylurea
SMILESNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C14H19N3O2/c15-14(19)16-10-11-4-6-12(7-5-11)13(18)17-8-2-1-3-9-17/h4-7H,1-3,8-10H2,(H3,15,16,19)
InChIKeyNKELRCJBVFMPFA-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.48
Rot. Bonds3

About [4-(piperidine-1-carbonyl)phenyl]methylurea

[4-(piperidine-1-carbonyl)phenyl]methylurea (PubChem CID 51073375) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is [4-(piperidine-1-carbonyl)phenyl]methylurea.

Molecular Properties

Compound Name[4-(piperidine-1-carbonyl)phenyl]methylurea
PubChem CID51073375
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name[4-(piperidine-1-carbonyl)phenyl]methylurea
SMILESNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C14H19N3O2/c15-14(19)16-10-11-4-6-12(7-5-11)13(18)17-8-2-1-3-9-17/h4-7H,1-3,8-10H2,(H3,15,16,19)
InChIKeyNKELRCJBVFMPFA-UHFFFAOYSA-N
XLogP1.48
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopropane-1-carboxamide
CID 119694800
1-amino-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclohexane-1-carboxamide
CID 119274102
N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide
CID 18119554
[4-[4-[(1S,2S)-2-hydroxycyclopentyl]piperazine-1-carbonyl]phenyl]methylurea
CID 96500816
[4-(aminomethyl)phenyl]-piperidin-1-ylmethanone
CID 7131263
tert-butyl N-[[4-(piperidine-1-carbonyl)phenyl]methyl]carbamate
CID 8868940
2-cyclopentyl-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]acetamide
CID 18159694
[4-(azocane-1-carbonyl)phenyl]-(azocan-1-yl)methanone
CID 3317192
1,2-dimethyl-3-[[4-(piperidine-1-carbonyl)phenyl]methyl]guanidine;hydroiodide
CID 110918753
[4-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]phenyl]methylurea
CID 79029145
[4-(3-methyl-3-phenylpiperidine-1-carbonyl)phenyl]methylurea
CID 119129647
4-(azacycloundecane-1-carbonyl)benzamide
CID 22253818

Frequently Asked Questions

What is the IUPAC name of [4-(piperidine-1-carbonyl)phenyl]methylurea?
The IUPAC name of [4-(piperidine-1-carbonyl)phenyl]methylurea (CID 51073375) is [4-(piperidine-1-carbonyl)phenyl]methylurea.
What is the SMILES notation for [4-(piperidine-1-carbonyl)phenyl]methylurea?
The canonical SMILES for [4-(piperidine-1-carbonyl)phenyl]methylurea is NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1.
What is the InChIKey of [4-(piperidine-1-carbonyl)phenyl]methylurea?
The InChIKey is NKELRCJBVFMPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-14(19)16-10-11-4-6-12(7-5-11)13(18)17-8-2-1-3-9-17/h4-7H,1-3,8-10H2,(H3,15,16,19).
What are the key properties of [4-(piperidine-1-carbonyl)phenyl]methylurea?
[4-(piperidine-1-carbonyl)phenyl]methylurea has a molecular weight of 261.32 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(piperidine-1-carbonyl)phenyl]methylurea is sourced from PubChem (CID 51073375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).