6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C18H21N5O — CID 86305374

IUPAC6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(C4CCCN4)c3)cnc21
InChIInChI=1S/C18H21N5O/c19-18(24)23-6-2-3-12-7-14(11-22-17(12)23)13-8-15(10-20-9-13)16-4-1-5-21-16/h7-11,16,21H,1-6H2,(H2,19,24)
InChIKeyGVMXVKGAYWEUJG-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.40
Rot. Bonds2

About 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305374) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305374
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(C4CCCN4)c3)cnc21
InChIInChI=1S/C18H21N5O/c19-18(24)23-6-2-3-12-7-14(11-22-17(12)23)13-8-15(10-20-9-13)16-4-1-5-21-16/h7-11,16,21H,1-6H2,(H2,19,24)
InChIKeyGVMXVKGAYWEUJG-UHFFFAOYSA-N
XLogP2.40
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305374) is 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1CCCc2cc(-c3cncc(C4CCCN4)c3)cnc21.
What is the InChIKey of 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is GVMXVKGAYWEUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c19-18(24)23-6-2-3-12-7-14(11-22-17(12)23)13-8-15(10-20-9-13)16-4-1-5-21-16/h7-11,16,21H,1-6H2,(H2,19,24).
What are the key properties of 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-pyrrolidin-2-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).