1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine

C9H16N2 — CID 123364560

IUPAC1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine
SMILESCCC(NC)C1=NCCC=C1
InChIInChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h4,6,8,10H,3,5,7H2,1-2H3
InChIKeyXBNJKSFQUGKUAO-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.39
Rot. Bonds3

About 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine

1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine (PubChem CID 123364560) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine
PubChem CID123364560
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine
SMILESCCC(NC)C1=NCCC=C1
InChIInChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h4,6,8,10H,3,5,7H2,1-2H3
InChIKeyXBNJKSFQUGKUAO-UHFFFAOYSA-N
XLogP1.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-prop-1-en-2-yl-2,3-dihydropyridine
CID 143332140
1-(2,6-dimethyl-4-pyridinyl)-N-methylpropan-1-amine
CID 107503443
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
CID 102647204
4-(2,3-dihydropyridin-6-yl)-N,N-dimethyl-4-(4-methylphenyl)butan-1-amine
CID 156889538
1-(2,6-dimethyl-3-pyridinyl)-N-methylpropan-1-amine
CID 105078634
1-(3,4-dichlorophenyl)-N-methylpropan-1-amine
CID 43486460
N,N-diethyl-4-[1-(methylamino)propyl]aniline
CID 70917104
(1R)-1-(2,6-dimethylphenyl)-N-methylpropan-1-amine
CID 70333956
1-(4-butan-2-ylphenyl)-N-methylpropan-1-amine
CID 43483040
N-methyl-1-(3-methylimidazol-4-yl)propan-1-amine
CID 82903287
1-(4,5-dimethylthiophen-2-yl)-N,3-dimethylpentan-1-amine
CID 115846218
2-[1-(methylamino)propyl]phenol
CID 12862798

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine?
The IUPAC name of 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine (CID 123364560) is 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine is CCC(NC)C1=NCCC=C1.
What is the InChIKey of 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine?
The InChIKey is XBNJKSFQUGKUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h4,6,8,10H,3,5,7H2,1-2H3.
What are the key properties of 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine?
1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine has a molecular weight of 152.24 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 123364560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).