tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate

C18H25N3O2 — CID 21084192

IUPACtert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate
SMILESCCc1nn2ccccc2c1N(CC1CC1)C(=O)OC(C)(C)C
InChIInChI=1S/C18H25N3O2/c1-5-14-16(15-8-6-7-11-21(15)19-14)20(12-13-9-10-13)17(22)23-18(2,3)4/h6-8,11,13H,5,9-10,12H2,1-4H3
InChIKeyLUXBFWVRCXNGOD-UHFFFAOYSA-N
MW315.42 g/mol
LogP4.05
Rot. Bonds4

About tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate

tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate (PubChem CID 21084192) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate
PubChem CID21084192
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Nametert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate
SMILESCCc1nn2ccccc2c1N(CC1CC1)C(=O)OC(C)(C)C
InChIInChI=1S/C18H25N3O2/c1-5-14-16(15-8-6-7-11-21(15)19-14)20(12-13-9-10-13)17(22)23-18(2,3)4/h6-8,11,13H,5,9-10,12H2,1-4H3
InChIKeyLUXBFWVRCXNGOD-UHFFFAOYSA-N
XLogP4.05
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate?
The IUPAC name of tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate (CID 21084192) is tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate.
What is the SMILES notation for tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate?
The canonical SMILES for tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate is CCc1nn2ccccc2c1N(CC1CC1)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate?
The InChIKey is LUXBFWVRCXNGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-5-14-16(15-8-6-7-11-21(15)19-14)20(12-13-9-10-13)17(22)23-18(2,3)4/h6-8,11,13H,5,9-10,12H2,1-4H3.
What are the key properties of tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate?
tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate has a molecular weight of 315.42 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(cyclopropylmethyl)-N-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)carbamate is sourced from PubChem (CID 21084192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).