N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine

C13H21N3 — CID 21064610

IUPACN,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine
SMILESCC(C)c1cc(N(C)C)c2c(n1)NCCC2
InChIInChI=1S/C13H21N3/c1-9(2)11-8-12(16(3)4)10-6-5-7-14-13(10)15-11/h8-9H,5-7H2,1-4H3,(H,14,15)
InChIKeyNKPBTKOCAAAXDG-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.63
Rot. Bonds2

About N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine

N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine (PubChem CID 21064610) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine
PubChem CID21064610
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine
SMILESCC(C)c1cc(N(C)C)c2c(n1)NCCC2
InChIInChI=1S/C13H21N3/c1-9(2)11-8-12(16(3)4)10-6-5-7-14-13(10)15-11/h8-9H,5-7H2,1-4H3,(H,14,15)
InChIKeyNKPBTKOCAAAXDG-UHFFFAOYSA-N
XLogP2.63
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine?
The IUPAC name of N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine (CID 21064610) is N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine.
What is the SMILES notation for N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine?
The canonical SMILES for N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine is CC(C)c1cc(N(C)C)c2c(n1)NCCC2.
What is the InChIKey of N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine?
The InChIKey is NKPBTKOCAAAXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9(2)11-8-12(16(3)4)10-6-5-7-14-13(10)15-11/h8-9H,5-7H2,1-4H3,(H,14,15).
What are the key properties of N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine?
N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine has a molecular weight of 219.33 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-4-amine is sourced from PubChem (CID 21064610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).