2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide

C20H23N5O3 — CID 110248384

IUPAC2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
SMILESNc1nc2c(cc1C(=O)NCc1ccccn1)CN(C(=O)C1CCCO1)CC2
InChIInChI=1S/C20H23N5O3/c21-18-15(19(26)23-11-14-4-1-2-7-22-14)10-13-12-25(8-6-16(13)24-18)20(27)17-5-3-9-28-17/h1-2,4,7,10,17H,3,5-6,8-9,11-12H2,(H2,21,24)(H,23,26)
InChIKeyBZVWTSVFGYUXDB-UHFFFAOYSA-N
MW381.44 g/mol
LogP1.05
Rot. Bonds4

About 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide

2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide (PubChem CID 110248384) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
PubChem CID110248384
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC Name2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
SMILESNc1nc2c(cc1C(=O)NCc1ccccn1)CN(C(=O)C1CCCO1)CC2
InChIInChI=1S/C20H23N5O3/c21-18-15(19(26)23-11-14-4-1-2-7-22-14)10-13-12-25(8-6-16(13)24-18)20(27)17-5-3-9-28-17/h1-2,4,7,10,17H,3,5-6,8-9,11-12H2,(H2,21,24)(H,23,26)
InChIKeyBZVWTSVFGYUXDB-UHFFFAOYSA-N
XLogP1.05
TPSA110.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The IUPAC name of 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide (CID 110248384) is 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide is Nc1nc2c(cc1C(=O)NCc1ccccn1)CN(C(=O)C1CCCO1)CC2.
What is the InChIKey of 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The InChIKey is BZVWTSVFGYUXDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c21-18-15(19(26)23-11-14-4-1-2-7-22-14)10-13-12-25(8-6-16(13)24-18)20(27)17-5-3-9-28-17/h1-2,4,7,10,17H,3,5-6,8-9,11-12H2,(H2,21,24)(H,23,26).
What are the key properties of 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide has a molecular weight of 381.44 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(oxolane-2-carbonyl)-N-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 110248384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).