N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine

C16H27N3 — CID 154285406

IUPACN,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine
SMILESCCN(CC)CCCN1CCc2nc(C)ccc2C1
InChIInChI=1S/C16H27N3/c1-4-18(5-2)10-6-11-19-12-9-16-15(13-19)8-7-14(3)17-16/h7-8H,4-6,9-13H2,1-3H3
InChIKeyYPVOVIRVEBNGQC-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.48
Rot. Bonds6

About N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine

N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine (PubChem CID 154285406) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine
PubChem CID154285406
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine
SMILESCCN(CC)CCCN1CCc2nc(C)ccc2C1
InChIInChI=1S/C16H27N3/c1-4-18(5-2)10-6-11-19-12-9-16-15(13-19)8-7-14(3)17-16/h7-8H,4-6,9-13H2,1-3H3
InChIKeyYPVOVIRVEBNGQC-UHFFFAOYSA-N
XLogP2.48
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine?
The IUPAC name of N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine (CID 154285406) is N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine.
What is the SMILES notation for N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine?
The canonical SMILES for N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine is CCN(CC)CCCN1CCc2nc(C)ccc2C1.
What is the InChIKey of N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine?
The InChIKey is YPVOVIRVEBNGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-18(5-2)10-6-11-19-12-9-16-15(13-19)8-7-14(3)17-16/h7-8H,4-6,9-13H2,1-3H3.
What are the key properties of N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine?
N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 2.48, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(2-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-amine is sourced from PubChem (CID 154285406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).