4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea

C8H12N4O — CID 146082295

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea
SMILESNC(=O)NC1CCCn2nccc21
InChIInChI=1S/C8H12N4O/c9-8(13)11-6-2-1-5-12-7(6)3-4-10-12/h3-4,6H,1-2,5H2,(H3,9,11,13)
InChIKeyIHUHIARKGSUBCC-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.39
Rot. Bonds1

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea

4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea (PubChem CID 146082295) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea
PubChem CID146082295
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea
SMILESNC(=O)NC1CCCn2nccc21
InChIInChI=1S/C8H12N4O/c9-8(13)11-6-2-1-5-12-7(6)3-4-10-12/h3-4,6H,1-2,5H2,(H3,9,11,13)
InChIKeyIHUHIARKGSUBCC-UHFFFAOYSA-N
XLogP0.39
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropanecarbonylamino)-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-yl)pyridine-4-carboxamide
CID 136558498
N-[(3S,3aR,6S,6aR)-3-acetamido-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-4-carboxamide
CID 167829074
N-(oxolan-3-ylmethoxy)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-4-carboxamide
CID 154864949
ethane;4-ethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 142387767
N-[1-[(3,3-dimethylcyclobutyl)methyl]-2-methylpiperidin-4-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-4-carboxamide
CID 166330207
N-[2-(3-benzyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-amine
CID 167884326
2-[2-(2-methylpyrazol-3-yl)pyrrolidin-1-yl]acetic acid
CID 25247982
[(3R)-1-(1,2-oxazole-3-carbonyl)piperidin-3-yl]urea
CID 177272408
[(3R)-1-[4-(3,3-difluoropiperidin-1-yl)phenyl]-2-oxopiperidin-3-yl]urea;molecular hydrogen
CID 142493531
4-[(4,4-difluoropiperidine-1-carbonyl)amino]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxylic acid
CID 166273794
2-(4-aminoquinazolin-2-yl)-3-oxo-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-yl)propanenitrile
CID 167841044
2,2,3,3-tetramethyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)cyclopropane-1-carboxamide
CID 127433298

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea (CID 146082295) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea is NC(=O)NC1CCCn2nccc21.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea?
The InChIKey is IHUHIARKGSUBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-8(13)11-6-2-1-5-12-7(6)3-4-10-12/h3-4,6H,1-2,5H2,(H3,9,11,13).
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea has a molecular weight of 180.21 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ylurea is sourced from PubChem (CID 146082295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).