(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide

C16H18N4O2 — CID 91309040

IUPAC(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide
SMILESCOc1ccc2nccc(NC(=O)C3=CC[C@H](N)CC3)c2n1
InChIInChI=1S/C16H18N4O2/c1-22-14-7-6-12-15(20-14)13(8-9-18-12)19-16(21)10-2-4-11(17)5-3-10/h2,6-9,11H,3-5,17H2,1H3,(H,18,19,21)/t11-/m0/s1
InChIKeyMXMWKLAGUAPEKZ-NSHDSACASA-N
MW298.35 g/mol
LogP2.01
Rot. Bonds3

About (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide

(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide (PubChem CID 91309040) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide.

Molecular Properties

Compound Name(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide
PubChem CID91309040
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide
SMILESCOc1ccc2nccc(NC(=O)C3=CC[C@H](N)CC3)c2n1
InChIInChI=1S/C16H18N4O2/c1-22-14-7-6-12-15(20-14)13(8-9-18-12)19-16(21)10-2-4-11(17)5-3-10/h2,6-9,11H,3-5,17H2,1H3,(H,18,19,21)/t11-/m0/s1
InChIKeyMXMWKLAGUAPEKZ-NSHDSACASA-N
XLogP2.01
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)-6-oxopiperidine-2-carboxamide
CID 57418806
(4R)-N-(6-methoxy-1,5-naphthyridin-4-yl)-4-(6H-[1,2]thiazolo[4,5-c]pyridin-5-ylmethylamino)cyclohexene-1-carboxamide
CID 91330368
(4R)-N-(6-methoxy-1,5-naphthyridin-4-yl)-4-[(3-oxo-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexene-1-carboxamide
CID 91083502
ethyl (3R,4R)-4-[(6-methoxy-1,5-naphthyridin-4-yl)carbamoylamino]piperidine-3-carboxylate
CID 57043032
4-(heptylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)piperidine-1-carboxamide
CID 22244402
N-(6-methoxy-1,5-naphthyridin-4-yl)-4-[methyl(phenylcarbamoyl)amino]piperidine-1-carboxamide
CID 91451664
1-[(2S,5R)-5-aminooxan-2-yl]-2-(6-methoxy-1,5-naphthyridin-4-yl)ethanone
CID 141309721
2-ethyl-N-(6-methoxy-1,5-naphthyridin-4-yl)nonanamide
CID 143637389
(2R)-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidine-2-carboxamide
CID 173033650
[(2S)-4-[(6-methoxy-1,5-naphthyridin-4-yl)carbamoyl]morpholin-2-yl]methylcarbamic acid
CID 69444143
N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-ylmethyl)cyclohexanamine;(6-methoxy-1,5-naphthyridin-4-yl)carbamic acid
CID 69378082
N-(6-methoxy-1,5-naphthyridin-4-yl)-1-[2-[4-(trifluoromethoxy)phenyl]ethyl]piperidine-4-carboxamide
CID 166629428

Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide?
The IUPAC name of (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide (CID 91309040) is (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide.
What is the SMILES notation for (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide?
The canonical SMILES for (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide is COc1ccc2nccc(NC(=O)C3=CC[C@H](N)CC3)c2n1.
What is the InChIKey of (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide?
The InChIKey is MXMWKLAGUAPEKZ-NSHDSACASA-N. The full InChI is InChI=1S/C16H18N4O2/c1-22-14-7-6-12-15(20-14)13(8-9-18-12)19-16(21)10-2-4-11(17)5-3-10/h2,6-9,11H,3-5,17H2,1H3,(H,18,19,21)/t11-/m0/s1.
What are the key properties of (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide?
(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide is sourced from PubChem (CID 91309040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).