(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone

C14H17FN2O2 — CID 131689400

IUPAC(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
SMILESCOCc1cncc2c1CCN(C(=O)C1(F)CC1)C2
InChIInChI=1S/C14H17FN2O2/c1-19-9-11-7-16-6-10-8-17(5-2-12(10)11)13(18)14(15)3-4-14/h6-7H,2-5,8-9H2,1H3
InChIKeyWMCXAAGGFONWDA-UHFFFAOYSA-N
MW264.30 g/mol
LogP1.61
Rot. Bonds3

About (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone

(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone (PubChem CID 131689400) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone.

Molecular Properties

Compound Name(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
PubChem CID131689400
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC Name(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
SMILESCOCc1cncc2c1CCN(C(=O)C1(F)CC1)C2
InChIInChI=1S/C14H17FN2O2/c1-19-9-11-7-16-6-10-8-17(5-2-12(10)11)13(18)14(15)3-4-14/h6-7H,2-5,8-9H2,1H3
InChIKeyWMCXAAGGFONWDA-UHFFFAOYSA-N
XLogP1.61
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(cyclopropylmethoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-pyridin-4-ylmethanone
CID 97381966
5-(cyclopropylmethoxymethyl)-N,N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
CID 97406097
N,N-dimethyl-2-[[7-(oxan-4-yl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine
CID 97463756
[5-[2-(dimethylamino)ethoxymethyl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-(oxan-4-yl)methanone
CID 97463759
2-[(7-benzyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methoxy]-N,N-dimethylacetamide
CID 97463788
N,N-dimethyl-2-[[7-(oxan-4-yl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]acetamide
CID 97463797
cyclopent-3-en-1-yl-[5-(pyridin-4-ylmethoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
CID 97463841
N,N-dimethyl-2-[[7-(oxolan-3-yl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methoxy]ethanamine
CID 118747168
[5-(ethoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-(3-fluoro-4-pyridinyl)methanone
CID 97463723
[5-[2-(dimethylamino)ethoxymethyl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-(oxan-4-yl)methanone;bis(2,2,2-trifluoroacetic acid)
CID 118746543
1-[4,4-Difluoro-3-(pyridin-4-ylmethoxymethyl)piperidin-1-yl]-3-methoxypropan-1-one
CID 124051357
[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-pyridin-4-ylmethanone
CID 97406094

Frequently Asked Questions

What is the IUPAC name of (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone?
The IUPAC name of (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone (CID 131689400) is (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone.
What is the SMILES notation for (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone?
The canonical SMILES for (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone is COCc1cncc2c1CCN(C(=O)C1(F)CC1)C2.
What is the InChIKey of (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone?
The InChIKey is WMCXAAGGFONWDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c1-19-9-11-7-16-6-10-8-17(5-2-12(10)11)13(18)14(15)3-4-14/h6-7H,2-5,8-9H2,1H3.
What are the key properties of (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone?
(1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone has a molecular weight of 264.30 g/mol, XLogP of 1.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-fluorocyclopropyl)-[5-(methoxymethyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone is sourced from PubChem (CID 131689400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).