7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine

C17H18BrN5 — CID 133483777

IUPAC7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine
SMILESBrc1cnc2c(NC3CCCCC3n3cccn3)ccnc2c1
InChIInChI=1S/C17H18BrN5/c18-12-10-15-17(20-11-12)14(6-8-19-15)22-13-4-1-2-5-16(13)23-9-3-7-21-23/h3,6-11,13,16H,1-2,4-5H2,(H,19,22)
InChIKeyMPWVNUDEVOSXPO-UHFFFAOYSA-N
MW372.27 g/mol
LogP4.18
Rot. Bonds3

About 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine

7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine (PubChem CID 133483777) has the molecular formula C17H18BrN5 and a molecular weight of 372.27 g/mol. Its IUPAC name is 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine.

Molecular Properties

Compound Name7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine
PubChem CID133483777
Molecular FormulaC17H18BrN5
Molecular Weight372.27 g/mol
Exact Mass371.07
IUPAC Name7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine
SMILESBrc1cnc2c(NC3CCCCC3n3cccn3)ccnc2c1
InChIInChI=1S/C17H18BrN5/c18-12-10-15-17(20-11-12)14(6-8-19-15)22-13-4-1-2-5-16(13)23-9-3-7-21-23/h3,6-11,13,16H,1-2,4-5H2,(H,19,22)
InChIKeyMPWVNUDEVOSXPO-UHFFFAOYSA-N
XLogP4.18
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.27
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

trans-(1R,2R)-2-N-(7-bromo-1,5-naphthyridin-4-yl)cyclohexane-1,2-diamine
CID 102738731
trans-(1S,2S)-2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 99777938
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 91648836
7-bromo-N-[2-(chloromethyl)cyclohexyl]-1,5-naphthyridin-4-amine
CID 106365685
7-bromo-N-[2-(chloromethyl)cyclopentyl]-1,5-naphthyridin-4-amine
CID 106365510
7-bromo-N-(1,4-dioxaspiro[4.5]decan-8-yl)-1,5-naphthyridin-4-amine
CID 133482136
4-[(7-bromo-1,5-naphthyridin-4-yl)amino]pyrrolidin-2-one
CID 105023349
[4-[(7-bromo-1,5-naphthyridin-4-yl)amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 133481723
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]-6-[(3-methylpiperidin-1-yl)methyl]phenol
CID 135546135
7-bromo-N-(2-pyrrolidin-2-ylethyl)-1,5-naphthyridin-4-amine
CID 114794555
7-bromo-N-(pyrrolidin-2-ylmethyl)-1,5-naphthyridin-4-amine
CID 113394440
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]-N-cyclopropylacetamide
CID 113394394

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine?
The IUPAC name of 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine (CID 133483777) is 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine.
What is the SMILES notation for 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine?
The canonical SMILES for 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine is Brc1cnc2c(NC3CCCCC3n3cccn3)ccnc2c1.
What is the InChIKey of 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine?
The InChIKey is MPWVNUDEVOSXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrN5/c18-12-10-15-17(20-11-12)14(6-8-19-15)22-13-4-1-2-5-16(13)23-9-3-7-21-23/h3,6-11,13,16H,1-2,4-5H2,(H,19,22).
What are the key properties of 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine?
7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine has a molecular weight of 372.27 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine is sourced from PubChem (CID 133483777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).