N-butan-2-yl-1,6-naphthyridin-2-amine

C12H15N3 — CID 167287552

IUPACN-butan-2-yl-1,6-naphthyridin-2-amine
SMILESCCC(C)Nc1ccc2cnccc2n1
InChIInChI=1S/C12H15N3/c1-3-9(2)14-12-5-4-10-8-13-7-6-11(10)15-12/h4-9H,3H2,1-2H3,(H,14,15)
InChIKeyIDCVJDXNXAKQOJ-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.84
Rot. Bonds3

About N-butan-2-yl-1,6-naphthyridin-2-amine

N-butan-2-yl-1,6-naphthyridin-2-amine (PubChem CID 167287552) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-butan-2-yl-1,6-naphthyridin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-1,6-naphthyridin-2-amine
PubChem CID167287552
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN-butan-2-yl-1,6-naphthyridin-2-amine
SMILESCCC(C)Nc1ccc2cnccc2n1
InChIInChI=1S/C12H15N3/c1-3-9(2)14-12-5-4-10-8-13-7-6-11(10)15-12/h4-9H,3H2,1-2H3,(H,14,15)
InChIKeyIDCVJDXNXAKQOJ-UHFFFAOYSA-N
XLogP2.84
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-butan-2-yl]isoquinolin-5-amine
CID 93261822
N-butan-2-yl-2-methyl-1,6-naphthyridine-3-carboxamide
CID 110848504
6-N-butan-2-ylpyridine-2,3,6-triamine
CID 79822121
2-N,4-N-di(butan-2-yl)pyrimidine-2,4-diamine
CID 112883470
N-(1,6-naphthyridin-2-yl)formamide
CID 87526338
3-(butan-2-ylamino)pyridine-4-carbothioamide
CID 114288006
butane;2-methyl-1,6-naphthyridine
CID 142826315
N-butan-2-yl-3-methyl-2,6-naphthyridin-1-amine
CID 71160428
N-(1-pyrazol-1-ylpropan-2-yl)quinolin-2-amine
CID 61462720
N-butan-2-yl-6-methylpyridin-2-amine
CID 60877372
N-butan-2-yl-1,6-naphthyridin-8-amine
CID 91953467
(4S)-1-N,1-N-diethyl-4-N-quinolin-2-ylpentane-1,4-diamine
CID 36691119

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-1,6-naphthyridin-2-amine?
The IUPAC name of N-butan-2-yl-1,6-naphthyridin-2-amine (CID 167287552) is N-butan-2-yl-1,6-naphthyridin-2-amine.
What is the SMILES notation for N-butan-2-yl-1,6-naphthyridin-2-amine?
The canonical SMILES for N-butan-2-yl-1,6-naphthyridin-2-amine is CCC(C)Nc1ccc2cnccc2n1.
What is the InChIKey of N-butan-2-yl-1,6-naphthyridin-2-amine?
The InChIKey is IDCVJDXNXAKQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-3-9(2)14-12-5-4-10-8-13-7-6-11(10)15-12/h4-9H,3H2,1-2H3,(H,14,15).
What are the key properties of N-butan-2-yl-1,6-naphthyridin-2-amine?
N-butan-2-yl-1,6-naphthyridin-2-amine has a molecular weight of 201.27 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-1,6-naphthyridin-2-amine is sourced from PubChem (CID 167287552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).