(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide

C20H23N7O — CID 138590972

IUPAC(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide
SMILESO=C(Nc1cc2cc(-c3cnc4n3CCNC4)cnc2cn1)[C@@H]1CCCNC1
InChIInChI=1S/C20H23N7O/c28-20(13-2-1-3-21-8-13)26-18-7-14-6-15(9-23-16(14)10-24-18)17-11-25-19-12-22-4-5-27(17)19/h6-7,9-11,13,21-22H,1-5,8,12H2,(H,24,26,28)/t13-/m1/s1
InChIKeyILDWAYFKTBHGHX-CYBMUJFWSA-N
MW377.45 g/mol
LogP1.53
Rot. Bonds3

About (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide

(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide (PubChem CID 138590972) has the molecular formula C20H23N7O and a molecular weight of 377.45 g/mol. Its IUPAC name is (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide
PubChem CID138590972
Molecular FormulaC20H23N7O
Molecular Weight377.45 g/mol
Exact Mass377.20
IUPAC Name(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide
SMILESO=C(Nc1cc2cc(-c3cnc4n3CCNC4)cnc2cn1)[C@@H]1CCCNC1
InChIInChI=1S/C20H23N7O/c28-20(13-2-1-3-21-8-13)26-18-7-14-6-15(9-23-16(14)10-24-18)17-11-25-19-12-22-4-5-27(17)19/h6-7,9-11,13,21-22H,1-5,8,12H2,(H,24,26,28)/t13-/m1/s1
InChIKeyILDWAYFKTBHGHX-CYBMUJFWSA-N
XLogP1.53
TPSA96.76 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide (CID 138590972) is (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide is O=C(Nc1cc2cc(-c3cnc4n3CCNC4)cnc2cn1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide?
The InChIKey is ILDWAYFKTBHGHX-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H23N7O/c28-20(13-2-1-3-21-8-13)26-18-7-14-6-15(9-23-16(14)10-24-18)17-11-25-19-12-22-4-5-27(17)19/h6-7,9-11,13,21-22H,1-5,8,12H2,(H,24,26,28)/t13-/m1/s1.
What are the key properties of (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide?
(3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 1.53, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1,7-naphthyridin-6-yl]piperidine-3-carboxamide is sourced from PubChem (CID 138590972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).