1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea

C19H23N5O3 — CID 118365355

IUPAC1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea
SMILESCCOc1n[nH]c2cc(NC(=O)NC(C)(COC)c3ccccc3)ncc12
InChIInChI=1S/C19H23N5O3/c1-4-27-17-14-11-20-16(10-15(14)23-24-17)21-18(25)22-19(2,12-26-3)13-8-6-5-7-9-13/h5-11H,4,12H2,1-3H3,(H,23,24)(H2,20,21,22,25)
InChIKeyDXEPIWIEEGZQOM-UHFFFAOYSA-N
MW369.43 g/mol
LogP3.04
Rot. Bonds7

About 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea

1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea (PubChem CID 118365355) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea.

Molecular Properties

Compound Name1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea
PubChem CID118365355
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Name1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea
SMILESCCOc1n[nH]c2cc(NC(=O)NC(C)(COC)c3ccccc3)ncc12
InChIInChI=1S/C19H23N5O3/c1-4-27-17-14-11-20-16(10-15(14)23-24-17)21-18(25)22-19(2,12-26-3)13-8-6-5-7-9-13/h5-11H,4,12H2,1-3H3,(H,23,24)(H2,20,21,22,25)
InChIKeyDXEPIWIEEGZQOM-UHFFFAOYSA-N
XLogP3.04
TPSA101.16 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(1S)-2-ethoxy-1-phenylethyl]-3-(3-methoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)urea
CID 118365348
1-(2-hydroxy-1-phenylpropyl)-3-(3-methoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)urea
CID 123506062
N,N-dimethyl-2-[[6-[[(1R)-1-phenylethyl]carbamoylamino]-1H-pyrazolo[4,3-c]pyridin-3-yl]oxy]acetamide
CID 118365087
1-[5-(difluoromethyl)-1-methyl-4-phenylpyrrolidin-3-yl]-3-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)urea
CID 123499565
1-[3-(2-methoxyethoxy)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(3R,4S)-4-phenylpyrrolidin-3-yl]urea
CID 118271987
methyl 2-[[3-(ethylamino)-1H-pyrazolo[4,3-c]pyridin-6-yl]carbamoylamino]-2-phenylacetate
CID 118272221
2-[(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)carbamoylamino]-2-(4-fluorophenyl)-N,N-dimethylacetamide
CID 118365240
1-[3-[2-(dimethylamino)ethoxy]-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-(1-phenylethyl)urea
CID 123854456
1-(3-methoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-[(3-methylphenyl)methyl]urea
CID 144599326
1-[(3-fluorophenyl)methyl]-3-(3-methoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)urea
CID 118365266
1-[(1S)-2-methoxy-1-phenylethyl]-3-[3-(2,2,2-trifluoroethylamino)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
CID 118381024
1-[3-ethoxy-4-(hydroxymethyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(1S)-2-hydroxy-2-methyl-1-phenylpropyl]urea
CID 118365277

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea?
The IUPAC name of 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea (CID 118365355) is 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea.
What is the SMILES notation for 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea?
The canonical SMILES for 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea is CCOc1n[nH]c2cc(NC(=O)NC(C)(COC)c3ccccc3)ncc12.
What is the InChIKey of 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea?
The InChIKey is DXEPIWIEEGZQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-4-27-17-14-11-20-16(10-15(14)23-24-17)21-18(25)22-19(2,12-26-3)13-8-6-5-7-9-13/h5-11H,4,12H2,1-3H3,(H,23,24)(H2,20,21,22,25).
What are the key properties of 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea?
1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea has a molecular weight of 369.43 g/mol, XLogP of 3.04, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxy-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-methoxy-2-phenylpropan-2-yl)urea is sourced from PubChem (CID 118365355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).