1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea

C14H19N7O — CID 167966617

IUPAC1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea
SMILESCn1nnc(NC(=O)NC2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C14H19N7O/c1-20-18-13(17-19-20)16-14(22)15-11-7-9-21(10-8-11)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H2,15,16,18,22)
InChIKeyGNKWXIHKZWHQDB-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.00
Rot. Bonds3

About 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea

1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea (PubChem CID 167966617) has the molecular formula C14H19N7O and a molecular weight of 301.35 g/mol. Its IUPAC name is 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea.

Molecular Properties

Compound Name1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea
PubChem CID167966617
Molecular FormulaC14H19N7O
Molecular Weight301.35 g/mol
Exact Mass301.17
IUPAC Name1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea
SMILESCn1nnc(NC(=O)NC2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C14H19N7O/c1-20-18-13(17-19-20)16-14(22)15-11-7-9-21(10-8-11)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H2,15,16,18,22)
InChIKeyGNKWXIHKZWHQDB-UHFFFAOYSA-N
XLogP1.00
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
CID 155657873
1-(1-phenylpiperidin-4-yl)-3-(thietan-3-yl)urea
CID 136562095
1-(1-phenylpiperidin-4-yl)-3-[4-(triazol-2-yl)phenyl]urea
CID 86830732
1-(1-phenylpiperidin-4-yl)-3-(1H-pyrrolo[3,2-b]pyridin-3-yl)urea
CID 146642263
1-(1-phenylpiperidin-4-yl)-3-(5-propyl-1,3,4-thiadiazol-2-yl)urea
CID 86830659
1-cyclopropyl-3-[(3S)-1-phenylpyrrolidin-3-yl]urea
CID 95312527
1-(3-chloro-2-fluorophenyl)-3-(1-phenylpiperidin-4-yl)urea
CID 86830653
1-[(1S,2R)-2-phenylcyclopropyl]-3-(1-phenylpiperidin-4-yl)urea
CID 51050042
1-phenylmethoxy-3-(1-phenylpiperidin-4-yl)urea
CID 86842294
2-amino-2-phenyl-N-(1-phenylpiperidin-4-yl)propanamide
CID 120595916
3-amino-N-(1-phenylpiperidin-4-yl)butanamide;dihydrochloride
CID 119863025
3-hydroxy-3-phenyl-N-(1-phenylpiperidin-4-yl)butanamide
CID 86785833

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea?
The IUPAC name of 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea (CID 167966617) is 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea.
What is the SMILES notation for 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea?
The canonical SMILES for 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea is Cn1nnc(NC(=O)NC2CCN(c3ccccc3)CC2)n1.
What is the InChIKey of 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea?
The InChIKey is GNKWXIHKZWHQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N7O/c1-20-18-13(17-19-20)16-14(22)15-11-7-9-21(10-8-11)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H2,15,16,18,22).
What are the key properties of 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea?
1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea has a molecular weight of 301.35 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyltetrazol-5-yl)-3-(1-phenylpiperidin-4-yl)urea is sourced from PubChem (CID 167966617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).