3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine

C14H21N3 — CID 123835006

IUPAC3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine
SMILESNC1CCCC(N2CCc3cnccc3C2)C1
InChIInChI=1S/C14H21N3/c15-13-2-1-3-14(8-13)17-7-5-11-9-16-6-4-12(11)10-17/h4,6,9,13-14H,1-3,5,7-8,10,15H2
InChIKeyONWWXOYCTPGLPL-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.71
Rot. Bonds1

About 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine

3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine (PubChem CID 123835006) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine
PubChem CID123835006
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine
SMILESNC1CCCC(N2CCc3cnccc3C2)C1
InChIInChI=1S/C14H21N3/c15-13-2-1-3-14(8-13)17-7-5-11-9-16-6-4-12(11)10-17/h4,6,9,13-14H,1-3,5,7-8,10,15H2
InChIKeyONWWXOYCTPGLPL-UHFFFAOYSA-N
XLogP1.71
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine?
The IUPAC name of 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine (CID 123835006) is 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine?
The canonical SMILES for 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine is NC1CCCC(N2CCc3cnccc3C2)C1.
What is the InChIKey of 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine?
The InChIKey is ONWWXOYCTPGLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c15-13-2-1-3-14(8-13)17-7-5-11-9-16-6-4-12(11)10-17/h4,6,9,13-14H,1-3,5,7-8,10,15H2.
What are the key properties of 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine?
3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine has a molecular weight of 231.34 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-1H-2,6-naphthyridin-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 123835006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).