7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine

C13H14BrN3 — CID 113463910

IUPAC7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine
SMILESCC1CC1CNc1ccnc2cc(Br)cnc12
InChIInChI=1S/C13H14BrN3/c1-8-4-9(8)6-16-11-2-3-15-12-5-10(14)7-17-13(11)12/h2-3,5,7-9H,4,6H2,1H3,(H,15,16)
InChIKeyDYGGWDOVGPXFKO-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.46
Rot. Bonds3

About 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine

7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine (PubChem CID 113463910) has the molecular formula C13H14BrN3 and a molecular weight of 292.18 g/mol. Its IUPAC name is 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine.

Molecular Properties

Compound Name7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine
PubChem CID113463910
Molecular FormulaC13H14BrN3
Molecular Weight292.18 g/mol
Exact Mass291.04
IUPAC Name7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine
SMILESCC1CC1CNc1ccnc2cc(Br)cnc12
InChIInChI=1S/C13H14BrN3/c1-8-4-9(8)6-16-11-2-3-15-12-5-10(14)7-17-13(11)12/h2-3,5,7-9H,4,6H2,1H3,(H,15,16)
InChIKeyDYGGWDOVGPXFKO-UHFFFAOYSA-N
XLogP3.46
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Bromo-1,7-naphthyridine
CID 12320238
6-Bromo-4-(piperazin-1-yl)quinoline
CID 17040080
1,5-Naphthyridin-4-amine
CID 589354
4-Bromo-1,5-naphthyridine
CID 15025737
1,5-Naphthyridin-3-amine
CID 589351
N-(7-bromoquinolin-4-yl)-N',N'-diethylethane-1,2-diamine
CID 10245549
4-N,8-N-bis[5-(diethylamino)pentan-2-yl]-1,5-naphthyridine-4,8-diamine
CID 155569213
7-Bromo-3,4-quinolinediamine
CID 91619941
8-Bromo-1,7-naphthyridine
CID 56689046
4-Bromo-3-quinolinamine
CID 613830
1-N,1-N-diethyl-4-N-(1,5-naphthyridin-4-yl)pentane-1,4-diamine
CID 224620
N',N'-diethyl-N-(1,5-naphthyridin-4-yl)propane-1,3-diamine
CID 155532114

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine?
The IUPAC name of 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine (CID 113463910) is 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine.
What is the SMILES notation for 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine?
The canonical SMILES for 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine is CC1CC1CNc1ccnc2cc(Br)cnc12.
What is the InChIKey of 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine?
The InChIKey is DYGGWDOVGPXFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3/c1-8-4-9(8)6-16-11-2-3-15-12-5-10(14)7-17-13(11)12/h2-3,5,7-9H,4,6H2,1H3,(H,15,16).
What are the key properties of 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine?
7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine has a molecular weight of 292.18 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-[(2-methylcyclopropyl)methyl]-1,5-naphthyridin-4-amine is sourced from PubChem (CID 113463910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).