(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine

C9H16N2 — CID 68983220

IUPAC(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine
SMILESCCN/C(C)=C/C1=NCCC1
InChIInChI=1S/C9H16N2/c1-3-10-8(2)7-9-5-4-6-11-9/h7,10H,3-6H2,1-2H3/b8-7+
InChIKeyOPNBWNAAVLNZBP-BQYQJAHWSA-N
MW152.24 g/mol
LogP1.73
Rot. Bonds3

About (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine

(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine (PubChem CID 68983220) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine.

Molecular Properties

Compound Name(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine
PubChem CID68983220
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine
SMILESCCN/C(C)=C/C1=NCCC1
InChIInChI=1S/C9H16N2/c1-3-10-8(2)7-9-5-4-6-11-9/h7,10H,3-6H2,1-2H3/b8-7+
InChIKeyOPNBWNAAVLNZBP-BQYQJAHWSA-N
XLogP1.73
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 ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4E)-N-(Propan-2-yl)-4-[(propan-2-yl)imino]pent-2-en-2-amine
CID 71353734
(Z)-N-ethyl-4-ethyliminopent-2-en-2-amine
CID 22857106
(Z)-N-propan-2-yl-4-propan-2-yliminopent-2-en-2-amine
CID 102023638
(Z)-N-propyl-4-propyliminopent-2-en-2-amine
CID 102026407
(Z)-1,7-difluoro-N-propyl-5-propyliminohept-3-en-3-amine
CID 156290789
(Z)-N-pentyl-4-pentyliminopent-2-en-2-amine
CID 162409410
(Z)-1-(4-fluoro-3,4-dihydro-2H-pyrrol-5-yl)but-1-en-2-amine
CID 162729112
(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-amine
CID 11194331
((1Z)-1-Methyl-2-(1-pyrrolin-2-yl)vinyl)(2-methylpropyl)amine
CID 11412728
N-[1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]-2-methylpropan-1-amine
CID 29925431
[6-(Ethylamino)-4-propylhepta-3,5-dien-2-ylidene]-methylazanium
CID 59120193
2-(3,4-dihydro-2H-pyrrol-1-ium-5-ylmethylidene)pyrrolidine
CID 60077816

Frequently Asked Questions

What is the IUPAC name of (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine?
The IUPAC name of (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine (CID 68983220) is (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine.
What is the SMILES notation for (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine?
The canonical SMILES for (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine is CCN/C(C)=C/C1=NCCC1.
What is the InChIKey of (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine?
The InChIKey is OPNBWNAAVLNZBP-BQYQJAHWSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-10-8(2)7-9-5-4-6-11-9/h7,10H,3-6H2,1-2H3/b8-7+.
What are the key properties of (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine?
(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine has a molecular weight of 152.24 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine is sourced from PubChem (CID 68983220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).