(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone

C17H14N2O2 — CID 53414360

IUPAC(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone
SMILESCOc1ccc2ccccc2c1C(=O)c1ccncc1N
InChIInChI=1S/C17H14N2O2/c1-21-15-7-6-11-4-2-3-5-12(11)16(15)17(20)13-8-9-19-10-14(13)18/h2-10H,18H2,1H3
InChIKeyRXBFTPGSWPDDLH-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.06
Rot. Bonds3

About (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone

(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone (PubChem CID 53414360) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone
PubChem CID53414360
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone
SMILESCOc1ccc2ccccc2c1C(=O)c1ccncc1N
InChIInChI=1S/C17H14N2O2/c1-21-15-7-6-11-4-2-3-5-12(11)16(15)17(20)13-8-9-19-10-14(13)18/h2-10H,18H2,1H3
InChIKeyRXBFTPGSWPDDLH-UHFFFAOYSA-N
XLogP3.06
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxyisoquinoline-5-carboxamide
CID 82573912
1-(3-methoxy-4-pyridinyl)-2-naphthalen-1-ylethanone
CID 105064886
2-methoxynaphthalene-1-carbonyl chloride
CID 3016662
(2-amino-3-methoxyphenyl)-isoquinolin-8-ylmethanone
CID 107469085
(3-amino-4-methoxyphenyl)-(2-methylnaphthalen-1-yl)methanone
CID 91678600
(2,7-dimethoxynaphthalen-1-yl)-naphthalen-1-ylmethanone
CID 139085652
(2-fluoro-6-methoxyphenyl)-isoquinolin-8-ylmethanone
CID 103134021
2-methoxy-N,N-dimethylnaphthalene-1-carboxamide
CID 23279235
(2-methoxynaphthalen-1-yl)-(1-propylindol-3-yl)methanone
CID 11152088
[amino-(2-methoxynaphthalen-1-yl)methylidene]azanium
CID 6347163
(3-amino-4-pyridinyl)-pyridin-3-ylmethanone
CID 53414422
(2-methoxynaphthalen-1-yl)-(1-pentylindol-3-yl)methanone
CID 11268746

Frequently Asked Questions

What is the IUPAC name of (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone?
The IUPAC name of (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone (CID 53414360) is (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone.
What is the SMILES notation for (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone?
The canonical SMILES for (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone is COc1ccc2ccccc2c1C(=O)c1ccncc1N.
What is the InChIKey of (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone?
The InChIKey is RXBFTPGSWPDDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-21-15-7-6-11-4-2-3-5-12(11)16(15)17(20)13-8-9-19-10-14(13)18/h2-10H,18H2,1H3.
What are the key properties of (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone?
(3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone has a molecular weight of 278.31 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-4-pyridinyl)-(2-methoxynaphthalen-1-yl)methanone is sourced from PubChem (CID 53414360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).