N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine

C11H16N2 — CID 70579189

IUPACN,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine
SMILESC=CCN(CC=C)C1=NC=CCC1
InChIInChI=1S/C11H16N2/c1-3-9-13(10-4-2)11-7-5-6-8-12-11/h3-4,6,8H,1-2,5,7,9-10H2
InChIKeyFZDRGPKCQYQMMD-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.37
Rot. Bonds4

About N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine

N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine (PubChem CID 70579189) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine
PubChem CID70579189
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC NameN,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine
SMILESC=CCN(CC=C)C1=NC=CCC1
InChIInChI=1S/C11H16N2/c1-3-9-13(10-4-2)11-7-5-6-8-12-11/h3-4,6,8H,1-2,5,7,9-10H2
InChIKeyFZDRGPKCQYQMMD-UHFFFAOYSA-N
XLogP2.37
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,8-Diazabicyclo(5.4.0)undecen-7-ene
CID 21979529
2,3,7,8-Tetrahydroimidazo[1,2-a]pyridine
CID 129198681
2-But-3-enyl-1-prop-2-enyl-4,5-dihydroimidazole
CID 21608187
1-(3,4-Dihydropyridin-2-yl)-4-methylpiperazine
CID 57261291
1,1,2-Tris(prop-2-enyl)imidazol-1-ium
CID 66670074
1,1,2,4-Tetrakis(prop-2-enyl)imidazol-1-ium
CID 66803283
1,2-bis(prop-2-enyl)-5,6-dihydro-4H-pyrimidine
CID 67934585
2-methyl-3-propyl-4H-pyrimidine
CID 68059140
1,1,2-Tris(prop-2-enyl)imidazol-1-ium chloride
CID 68571596
3,3-dimethyl-2-propyl-4H-pyrimidin-3-ium
CID 70223891
1-Prop-2-enyl-3,4-dihydropyridin-2-imine
CID 70629599
N-methyl-N-pent-4-enyl-N'-prop-1-en-2-ylethanimidamide
CID 89192495

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine?
The IUPAC name of N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine (CID 70579189) is N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine.
What is the SMILES notation for N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine?
The canonical SMILES for N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine is C=CCN(CC=C)C1=NC=CCC1.
What is the InChIKey of N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine?
The InChIKey is FZDRGPKCQYQMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-3-9-13(10-4-2)11-7-5-6-8-12-11/h3-4,6,8H,1-2,5,7,9-10H2.
What are the key properties of N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine?
N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine has a molecular weight of 176.26 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)-3,4-dihydropyridin-2-amine is sourced from PubChem (CID 70579189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).