1-(1-prop-1-en-2-ylcyclopropyl)ethenamine

C8H13N — CID 142413607

IUPAC1-(1-prop-1-en-2-ylcyclopropyl)ethenamine
SMILESC=C(C)C1(C(=C)N)CC1
InChIInChI=1S/C8H13N/c1-6(2)8(4-5-8)7(3)9/h1,3-5,9H2,2H3
InChIKeyXKWGUUYFZUWNMA-UHFFFAOYSA-N
MW123.20 g/mol
LogP1.82
Rot. Bonds2

About 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine

1-(1-prop-1-en-2-ylcyclopropyl)ethenamine (PubChem CID 142413607) has the molecular formula C8H13N and a molecular weight of 123.20 g/mol. Its IUPAC name is 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine.

Molecular Properties

Compound Name1-(1-prop-1-en-2-ylcyclopropyl)ethenamine
PubChem CID142413607
Molecular FormulaC8H13N
Molecular Weight123.20 g/mol
Exact Mass123.10
IUPAC Name1-(1-prop-1-en-2-ylcyclopropyl)ethenamine
SMILESC=C(C)C1(C(=C)N)CC1
InChIInChI=1S/C8H13N/c1-6(2)8(4-5-8)7(3)9/h1,3-5,9H2,2H3
InChIKeyXKWGUUYFZUWNMA-UHFFFAOYSA-N
XLogP1.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.20
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-1-(1-prop-1-en-2-ylcyclopropyl)ethenamine
CID 142064517
1-prop-1-en-2-ylcyclohexane-1-carboxylic acid
CID 20575445
N'-hydroxy-1-[(3E)-2-methylpenta-1,3-dien-3-yl]cyclopropane-1-carboximidamide
CID 177007210
(2E)-N-[1-(1-prop-1-en-2-ylcyclopropyl)ethenyl]penta-2,4-dien-2-amine
CID 142413614
4-ethenyl-4-methyl-1-prop-1-en-2-ylcyclohexane-1-carboxylic acid
CID 143093730
prop-1-en-2-amine;yttrium
CID 158882655
bis(carbamodithioic acid);2-methylprop-1-ene
CID 88714741
4-acetyl-4-prop-1-en-2-ylcyclohexan-1-one
CID 12560161
ethane;tris(2-methylprop-1-ene)
CID 144520420
methane;tetrakis(2-methylprop-1-ene)
CID 159196476
methanamine;N'-methylethanimidamide;2-methylprop-1-ene
CID 142054622
(Z)-but-2-ene;1-[(E)-but-2-en-2-yl]cyclopropane-1-carboxamide
CID 143237605

Frequently Asked Questions

What is the IUPAC name of 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine?
The IUPAC name of 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine (CID 142413607) is 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine.
What is the SMILES notation for 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine?
The canonical SMILES for 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine is C=C(C)C1(C(=C)N)CC1.
What is the InChIKey of 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine?
The InChIKey is XKWGUUYFZUWNMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N/c1-6(2)8(4-5-8)7(3)9/h1,3-5,9H2,2H3.
What are the key properties of 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine?
1-(1-prop-1-en-2-ylcyclopropyl)ethenamine has a molecular weight of 123.20 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-prop-1-en-2-ylcyclopropyl)ethenamine is sourced from PubChem (CID 142413607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).