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

C12H19N3 — CID 21064637

IUPAC4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine
SMILESCc1cc(NC(C)C)nc2c1CCCN2
InChIInChI=1S/C12H19N3/c1-8(2)14-11-7-9(3)10-5-4-6-13-12(10)15-11/h7-8H,4-6H2,1-3H3,(H2,13,14,15)
InChIKeyIQHHJSODMGCYGO-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.57
Rot. Bonds2

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

4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine (PubChem CID 21064637) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine.

Molecular Properties

Compound Name4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine
PubChem CID21064637
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine
SMILESCc1cc(NC(C)C)nc2c1CCCN2
InChIInChI=1S/C12H19N3/c1-8(2)14-11-7-9(3)10-5-4-6-13-12(10)15-11/h7-8H,4-6H2,1-3H3,(H2,13,14,15)
InChIKeyIQHHJSODMGCYGO-UHFFFAOYSA-N
XLogP2.57
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine?
The IUPAC name of 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine (CID 21064637) is 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine.
What is the SMILES notation for 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine?
The canonical SMILES for 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine is Cc1cc(NC(C)C)nc2c1CCCN2.
What is the InChIKey of 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine?
The InChIKey is IQHHJSODMGCYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-8(2)14-11-7-9(3)10-5-4-6-13-12(10)15-11/h7-8H,4-6H2,1-3H3,(H2,13,14,15).
What are the key properties of 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine?
4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine has a molecular weight of 205.31 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propan-2-yl-5,6,7,8-tetrahydro-1,8-naphthyridin-2-amine is sourced from PubChem (CID 21064637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).