1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea

C18H24N6O — CID 127461155

IUPAC1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea
SMILESO=C(NC1CCN(c2ccccn2)CC1)NC1CCc2cn[nH]c2C1
InChIInChI=1S/C18H24N6O/c25-18(22-15-5-4-13-12-20-23-16(13)11-15)21-14-6-9-24(10-7-14)17-3-1-2-8-19-17/h1-3,8,12,14-15H,4-7,9-11H2,(H,20,23)(H2,21,22,25)
InChIKeyFAYWDCCHCYCGNM-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.63
Rot. Bonds3

About 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea

1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea (PubChem CID 127461155) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea.

Molecular Properties

Compound Name1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea
PubChem CID127461155
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea
SMILESO=C(NC1CCN(c2ccccn2)CC1)NC1CCc2cn[nH]c2C1
InChIInChI=1S/C18H24N6O/c25-18(22-15-5-4-13-12-20-23-16(13)11-15)21-14-6-9-24(10-7-14)17-3-1-2-8-19-17/h1-3,8,12,14-15H,4-7,9-11H2,(H,20,23)(H2,21,22,25)
InChIKeyFAYWDCCHCYCGNM-UHFFFAOYSA-N
XLogP1.63
TPSA85.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea with MolForge

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Related Compounds

1-[(2S,3R)-2-phenyloxolan-3-yl]-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea
CID 136584840
6-piperazin-1-yl-N-(4,5,6,7-tetrahydro-1H-indazol-6-yl)pyridazine-3-carboxamide
CID 167777555
1-(2-methylcyclopentyl)-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 56826840
1-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea
CID 136514487
N-(1-pyridin-2-ylpiperidin-4-yl)-2H-triazole-4-carboxamide
CID 112731973
N-(4,5,6,7-tetrahydro-1H-indazol-6-yl)acetamide
CID 20546780
2-[(1-pyridin-2-ylpiperidin-4-yl)carbamoylamino]ethylcarbamic acid
CID 69019671
2,2-difluoro-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 103514862
1-[(2R)-butan-2-yl]-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 94148159
N-(1-pyridin-2-ylpiperidin-4-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 47048730
1-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 111630604
N-(1-pyridin-2-ylpiperidin-4-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide;dihydrochloride
CID 119854490

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea?
The IUPAC name of 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea (CID 127461155) is 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea.
What is the SMILES notation for 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea?
The canonical SMILES for 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea is O=C(NC1CCN(c2ccccn2)CC1)NC1CCc2cn[nH]c2C1.
What is the InChIKey of 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea?
The InChIKey is FAYWDCCHCYCGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c25-18(22-15-5-4-13-12-20-23-16(13)11-15)21-14-6-9-24(10-7-14)17-3-1-2-8-19-17/h1-3,8,12,14-15H,4-7,9-11H2,(H,20,23)(H2,21,22,25).
What are the key properties of 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea?
1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea has a molecular weight of 340.43 g/mol, XLogP of 1.63, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyridin-2-ylpiperidin-4-yl)-3-(4,5,6,7-tetrahydro-1H-indazol-6-yl)urea is sourced from PubChem (CID 127461155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).