N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine

C10H16N2 — CID 163850274

IUPACN-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine
SMILESC=C(NCCC)C1=NC=CCC1
InChIInChI=1S/C10H16N2/c1-3-7-11-9(2)10-6-4-5-8-12-10/h5,8,11H,2-4,6-7H2,1H3
InChIKeyOTTUQGQUGXGIIA-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.25
Rot. Bonds4

About N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine

N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine (PubChem CID 163850274) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine
PubChem CID163850274
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine
SMILESC=C(NCCC)C1=NC=CCC1
InChIInChI=1S/C10H16N2/c1-3-7-11-9(2)10-6-4-5-8-12-10/h5,8,11H,2-4,6-7H2,1H3
InChIKeyOTTUQGQUGXGIIA-UHFFFAOYSA-N
XLogP2.25
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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[2-(4,5-Dihydro-3H-pyrrol-2-yl)-1-methyl-vinyl]-ethyl-amine
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1-(3,4-dihydropyridin-2-yl)-N-(2,3-dihydropyridin-6-ylmethyl)methanamine
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N-ethyl-3-hexa-1,4,5-trienyliminononan-1-amine
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2-[(4Z)-3,6-dihydroazocin-2-yl]-N-methylethanamine
CID 135244701
1-piperidin-4-yl-N-[(E)-prop-1-enyl]prop-2-en-1-imine
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(Z)-1-(butan-2-ylideneamino)-N-ethylhex-1-en-2-amine
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3-Ethenyl-2-methyl-5-(2-methylpentan-2-yl)-1,2-dihydropyrazine
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CID 142295426

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine?
The IUPAC name of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine (CID 163850274) is N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine.
What is the SMILES notation for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine?
The canonical SMILES for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine is C=C(NCCC)C1=NC=CCC1.
What is the InChIKey of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine?
The InChIKey is OTTUQGQUGXGIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-7-11-9(2)10-6-4-5-8-12-10/h5,8,11H,2-4,6-7H2,1H3.
What are the key properties of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine?
N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine has a molecular weight of 164.25 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]propan-1-amine is sourced from PubChem (CID 163850274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).