(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone

C14H19N5O2 — CID 139005848

IUPAC(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone
SMILESCC(C)(C)C1CN(C(=O)c2ccc3nnnn3c2)CCO1
InChIInChI=1S/C14H19N5O2/c1-14(2,3)11-9-18(6-7-21-11)13(20)10-4-5-12-15-16-17-19(12)8-10/h4-5,8,11H,6-7,9H2,1-3H3
InChIKeyRNWNHGDZAVVPCH-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.01
Rot. Bonds1

About (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone

(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone (PubChem CID 139005848) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone.

Molecular Properties

Compound Name(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone
PubChem CID139005848
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone
SMILESCC(C)(C)C1CN(C(=O)c2ccc3nnnn3c2)CCO1
InChIInChI=1S/C14H19N5O2/c1-14(2,3)11-9-18(6-7-21-11)13(20)10-4-5-12-15-16-17-19(12)8-10/h4-5,8,11H,6-7,9H2,1-3H3
InChIKeyRNWNHGDZAVVPCH-UHFFFAOYSA-N
XLogP1.01
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The IUPAC name of (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone (CID 139005848) is (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone.
What is the SMILES notation for (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The canonical SMILES for (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone is CC(C)(C)C1CN(C(=O)c2ccc3nnnn3c2)CCO1.
What is the InChIKey of (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The InChIKey is RNWNHGDZAVVPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-14(2,3)11-9-18(6-7-21-11)13(20)10-4-5-12-15-16-17-19(12)8-10/h4-5,8,11H,6-7,9H2,1-3H3.
What are the key properties of (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
(2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone has a molecular weight of 289.34 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butylmorpholin-4-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone is sourced from PubChem (CID 139005848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).