tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate

C17H25N5O3 — CID 90445194

IUPACtert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate
SMILESCC(C)(C)OC(=O)N(CCN1CCOCC1)c1n[nH]c2cnccc12
InChIInChI=1S/C17H25N5O3/c1-17(2,3)25-16(23)22(7-6-21-8-10-24-11-9-21)15-13-4-5-18-12-14(13)19-20-15/h4-5,12H,6-11H2,1-3H3,(H,19,20)
InChIKeyHDDJOLRCCFTWSG-UHFFFAOYSA-N
MW347.42 g/mol
LogP2.03
Rot. Bonds4

About tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate

tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate (PubChem CID 90445194) has the molecular formula C17H25N5O3 and a molecular weight of 347.42 g/mol. Its IUPAC name is tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate
PubChem CID90445194
Molecular FormulaC17H25N5O3
Molecular Weight347.42 g/mol
Exact Mass347.20
IUPAC Nametert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate
SMILESCC(C)(C)OC(=O)N(CCN1CCOCC1)c1n[nH]c2cnccc12
InChIInChI=1S/C17H25N5O3/c1-17(2,3)25-16(23)22(7-6-21-8-10-24-11-9-21)15-13-4-5-18-12-14(13)19-20-15/h4-5,12H,6-11H2,1-3H3,(H,19,20)
InChIKeyHDDJOLRCCFTWSG-UHFFFAOYSA-N
XLogP2.03
TPSA83.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate?
The IUPAC name of tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate (CID 90445194) is tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate.
What is the SMILES notation for tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate?
The canonical SMILES for tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate is CC(C)(C)OC(=O)N(CCN1CCOCC1)c1n[nH]c2cnccc12.
What is the InChIKey of tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate?
The InChIKey is HDDJOLRCCFTWSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O3/c1-17(2,3)25-16(23)22(7-6-21-8-10-24-11-9-21)15-13-4-5-18-12-14(13)19-20-15/h4-5,12H,6-11H2,1-3H3,(H,19,20).
What are the key properties of tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate?
tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate has a molecular weight of 347.42 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2-morpholin-4-ylethyl)-N-(1H-pyrazolo[5,4-c]pyridin-3-yl)carbamate is sourced from PubChem (CID 90445194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).