N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide

C18H16N4O2 — CID 99787443

IUPACN-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide
SMILESC[C@](NC(=O)c1ccnc2ccncc12)(C(N)=O)c1ccccc1
InChIInChI=1S/C18H16N4O2/c1-18(17(19)24,12-5-3-2-4-6-12)22-16(23)13-7-10-21-15-8-9-20-11-14(13)15/h2-11H,1H3,(H2,19,24)(H,22,23)/t18-/m1/s1
InChIKeyVVOUYWTXHGGKEO-GOSISDBHSA-N
MW320.35 g/mol
LogP1.76
Rot. Bonds4

About N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide

N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide (PubChem CID 99787443) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide
PubChem CID99787443
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC NameN-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide
SMILESC[C@](NC(=O)c1ccnc2ccncc12)(C(N)=O)c1ccccc1
InChIInChI=1S/C18H16N4O2/c1-18(17(19)24,12-5-3-2-4-6-12)22-16(23)13-7-10-21-15-8-9-20-11-14(13)15/h2-11H,1H3,(H2,19,24)(H,22,23)/t18-/m1/s1
InChIKeyVVOUYWTXHGGKEO-GOSISDBHSA-N
XLogP1.76
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide?
The IUPAC name of N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide (CID 99787443) is N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide.
What is the SMILES notation for N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide?
The canonical SMILES for N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide is C[C@](NC(=O)c1ccnc2ccncc12)(C(N)=O)c1ccccc1.
What is the InChIKey of N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide?
The InChIKey is VVOUYWTXHGGKEO-GOSISDBHSA-N. The full InChI is InChI=1S/C18H16N4O2/c1-18(17(19)24,12-5-3-2-4-6-12)22-16(23)13-7-10-21-15-8-9-20-11-14(13)15/h2-11H,1H3,(H2,19,24)(H,22,23)/t18-/m1/s1.
What are the key properties of N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide?
N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide is sourced from PubChem (CID 99787443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).