1-(2,3-dihydropyridin-6-yl)propan-2-amine

C8H14N2 — CID 123723453

IUPAC1-(2,3-dihydropyridin-6-yl)propan-2-amine
SMILESCC(N)CC1=NCCC=C1
InChIInChI=1S/C8H14N2/c1-7(9)6-8-4-2-3-5-10-8/h2,4,7H,3,5-6,9H2,1H3
InChIKeyTZQAQFLNIWMFAF-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.12
Rot. Bonds2

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

1-(2,3-dihydropyridin-6-yl)propan-2-amine (PubChem CID 123723453) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-(2,3-dihydropyridin-6-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2,3-dihydropyridin-6-yl)propan-2-amine
PubChem CID123723453
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-(2,3-dihydropyridin-6-yl)propan-2-amine
SMILESCC(N)CC1=NCCC=C1
InChIInChI=1S/C8H14N2/c1-7(9)6-8-4-2-3-5-10-8/h2,4,7H,3,5-6,9H2,1H3
InChIKeyTZQAQFLNIWMFAF-UHFFFAOYSA-N
XLogP1.12
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-Fluorocyclohex-2-en-1-ylidene)amino]ethanamine
CID 123344748
4-Diazo-2,3-diethylcyclohexa-2,5-dien-1-amine
CID 20209398
[6-(3-Methylideneoctyl)-2,3-dihydropyridin-2-yl]methanamine
CID 91229717
2-Iminocyclohex-3-en-1-amine
CID 91537045
(Z)-4-methyliminohex-2-en-1-amine
CID 123191267
4-Iminocyclohex-2-en-1-amine
CID 123227294
1-(2,3-dihydropyridin-6-yl)-N-methylpropan-1-amine
CID 123364560
2-(Cyclohex-2-en-1-ylideneamino)ethanamine
CID 123456351
(Z)-4-N-methylhept-5-ene-3,4-diimine
CID 123482216
1-(2,3-Dihydropyridin-6-yl)-5-methyloct-4-en-1-amine
CID 123499287
2-N-ethylcyclohex-3-ene-1,2-diimine
CID 123566482
4-N-ethyl-2-methylcyclohexa-2,5-diene-1,4-diimine
CID 123632189

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydropyridin-6-yl)propan-2-amine?
The IUPAC name of 1-(2,3-dihydropyridin-6-yl)propan-2-amine (CID 123723453) is 1-(2,3-dihydropyridin-6-yl)propan-2-amine.
What is the SMILES notation for 1-(2,3-dihydropyridin-6-yl)propan-2-amine?
The canonical SMILES for 1-(2,3-dihydropyridin-6-yl)propan-2-amine is CC(N)CC1=NCCC=C1.
What is the InChIKey of 1-(2,3-dihydropyridin-6-yl)propan-2-amine?
The InChIKey is TZQAQFLNIWMFAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-7(9)6-8-4-2-3-5-10-8/h2,4,7H,3,5-6,9H2,1H3.
What are the key properties of 1-(2,3-dihydropyridin-6-yl)propan-2-amine?
1-(2,3-dihydropyridin-6-yl)propan-2-amine has a molecular weight of 138.21 g/mol, XLogP of 1.12, 2 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)propan-2-amine is sourced from PubChem (CID 123723453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).