N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide

C20H19N3O2 — CID 3975213

IUPACN-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H19N3O2/c24-20(17-6-5-15-3-1-2-4-16(15)13-17)22-18-7-8-19(21-14-18)23-9-11-25-12-10-23/h1-8,13-14H,9-12H2,(H,22,24)
InChIKeyBLJBSPDCBXNONI-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.32
Rot. Bonds3

About N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide

N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide (PubChem CID 3975213) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
PubChem CID3975213
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H19N3O2/c24-20(17-6-5-15-3-1-2-4-16(15)13-17)22-18-7-8-19(21-14-18)23-9-11-25-12-10-23/h1-8,13-14H,9-12H2,(H,22,24)
InChIKeyBLJBSPDCBXNONI-UHFFFAOYSA-N
XLogP3.32
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide?
The IUPAC name of N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide (CID 3975213) is N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide is O=C(Nc1ccc(N2CCOCC2)nc1)c1ccc2ccccc2c1.
What is the InChIKey of N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide?
The InChIKey is BLJBSPDCBXNONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c24-20(17-6-5-15-3-1-2-4-16(15)13-17)22-18-7-8-19(21-14-18)23-9-11-25-12-10-23/h1-8,13-14H,9-12H2,(H,22,24).
What are the key properties of N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide?
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide is sourced from PubChem (CID 3975213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).