N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide

C23H27N9O4 — CID 146604083

IUPACN-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
SMILESC[C@H](CO)n1nnnc1-c1cccc(NC(=O)c2cc3c(cn2)CCN(C(=O)N2CCOCC2)C3)n1
InChIInChI=1S/C23H27N9O4/c1-15(14-33)32-21(27-28-29-32)18-3-2-4-20(25-18)26-22(34)19-11-17-13-31(6-5-16(17)12-24-19)23(35)30-7-9-36-10-8-30/h2-4,11-12,15,33H,5-10,13-14H2,1H3,(H,25,26,34)/t15-/m1/s1
InChIKeyHFKYVHHNOFUBFJ-OAHLLOKOSA-N
MW493.53 g/mol
LogP0.75
Rot. Bonds5

About N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide

N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide (PubChem CID 146604083) has the molecular formula C23H27N9O4 and a molecular weight of 493.53 g/mol. Its IUPAC name is N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
PubChem CID146604083
Molecular FormulaC23H27N9O4
Molecular Weight493.53 g/mol
Exact Mass493.22
IUPAC NameN-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
SMILESC[C@H](CO)n1nnnc1-c1cccc(NC(=O)c2cc3c(cn2)CCN(C(=O)N2CCOCC2)C3)n1
InChIInChI=1S/C23H27N9O4/c1-15(14-33)32-21(27-28-29-32)18-3-2-4-20(25-18)26-22(34)19-11-17-13-31(6-5-16(17)12-24-19)23(35)30-7-9-36-10-8-30/h2-4,11-12,15,33H,5-10,13-14H2,1H3,(H,25,26,34)/t15-/m1/s1
InChIKeyHFKYVHHNOFUBFJ-OAHLLOKOSA-N
XLogP0.75
TPSA151.49 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.53
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide?
The IUPAC name of N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide (CID 146604083) is N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide.
What is the SMILES notation for N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide?
The canonical SMILES for N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide is C[C@H](CO)n1nnnc1-c1cccc(NC(=O)c2cc3c(cn2)CCN(C(=O)N2CCOCC2)C3)n1.
What is the InChIKey of N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide?
The InChIKey is HFKYVHHNOFUBFJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C23H27N9O4/c1-15(14-33)32-21(27-28-29-32)18-3-2-4-20(25-18)26-22(34)19-11-17-13-31(6-5-16(17)12-24-19)23(35)30-7-9-36-10-8-30/h2-4,11-12,15,33H,5-10,13-14H2,1H3,(H,25,26,34)/t15-/m1/s1.
What are the key properties of N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide?
N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide has a molecular weight of 493.53 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(morpholine-4-carbonyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 146604083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).