3-bromoprop-2-en-1-amine;hydrobromide

C3H7Br2N — CID 173147097

IUPAC3-bromoprop-2-en-1-amine;hydrobromide
SMILESBr.NCC=CBr
InChIInChI=1S/C3H6BrN.BrH/c4-2-1-3-5;/h1-2H,3,5H2;1H
InChIKeyKIVLCKKTSGAMNU-UHFFFAOYSA-N
MW216.90 g/mol
LogP1.43
Rot. Bonds1

About 3-bromoprop-2-en-1-amine;hydrobromide

3-bromoprop-2-en-1-amine;hydrobromide (PubChem CID 173147097) has the molecular formula C3H7Br2N and a molecular weight of 216.90 g/mol. Its IUPAC name is 3-bromoprop-2-en-1-amine;hydrobromide.

Molecular Properties

Compound Name3-bromoprop-2-en-1-amine;hydrobromide
PubChem CID173147097
Molecular FormulaC3H7Br2N
Molecular Weight216.90 g/mol
Exact Mass214.89
IUPAC Name3-bromoprop-2-en-1-amine;hydrobromide
SMILESBr.NCC=CBr
InChIInChI=1S/C3H6BrN.BrH/c4-2-1-3-5;/h1-2H,3,5H2;1H
InChIKeyKIVLCKKTSGAMNU-UHFFFAOYSA-N
XLogP1.43
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.90
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-4-bromobut-3-en-1-amine
CID 89333756
hepta-2,5-diene-1,7-diamine
CID 56638039
(E)-1-bromo-3-iodoprop-1-ene
CID 12046677
prop-1-ene-1,3-diamine;hydroiodide
CID 173353144
3-aminoprop-1-ene-1-thiol
CID 173002816
N-(2-bromoethyl)prop-1-ene-1,3-diamine;hydrobromide
CID 175317001
(E)-1,4-dibromobut-1-ene
CID 14316427
N-(3-aminoprop-1-enyl)hydroxylamine
CID 174764651
(E)-3-bromo-N,N-dimethylprop-2-en-1-amine
CID 23271071
4-(2-methoxyethoxy)but-2-en-1-amine
CID 77110475
2-(3-aminoprop-1-enyl)-3-bromophenol
CID 169464695
(E)-1-bromohex-1-ene
CID 5362769

Frequently Asked Questions

What is the IUPAC name of 3-bromoprop-2-en-1-amine;hydrobromide?
The IUPAC name of 3-bromoprop-2-en-1-amine;hydrobromide (CID 173147097) is 3-bromoprop-2-en-1-amine;hydrobromide.
What is the SMILES notation for 3-bromoprop-2-en-1-amine;hydrobromide?
The canonical SMILES for 3-bromoprop-2-en-1-amine;hydrobromide is Br.NCC=CBr.
What is the InChIKey of 3-bromoprop-2-en-1-amine;hydrobromide?
The InChIKey is KIVLCKKTSGAMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6BrN.BrH/c4-2-1-3-5;/h1-2H,3,5H2;1H.
What are the key properties of 3-bromoprop-2-en-1-amine;hydrobromide?
3-bromoprop-2-en-1-amine;hydrobromide has a molecular weight of 216.90 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromoprop-2-en-1-amine;hydrobromide is sourced from PubChem (CID 173147097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).