5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine

C10H14BrN3 — CID 61228482

IUPAC5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine
SMILESCCN(c1ncc(Br)cc1N)C1CC1
InChIInChI=1S/C10H14BrN3/c1-2-14(8-3-4-8)10-9(12)5-7(11)6-13-10/h5-6,8H,2-4,12H2,1H3
InChIKeyOBEMTYVPAILEFI-UHFFFAOYSA-N
MW256.15 g/mol
LogP2.41
Rot. Bonds3

About 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine

5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine (PubChem CID 61228482) has the molecular formula C10H14BrN3 and a molecular weight of 256.15 g/mol. Its IUPAC name is 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine
PubChem CID61228482
Molecular FormulaC10H14BrN3
Molecular Weight256.15 g/mol
Exact Mass255.04
IUPAC Name5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine
SMILESCCN(c1ncc(Br)cc1N)C1CC1
InChIInChI=1S/C10H14BrN3/c1-2-14(8-3-4-8)10-9(12)5-7(11)6-13-10/h5-6,8H,2-4,12H2,1H3
InChIKeyOBEMTYVPAILEFI-UHFFFAOYSA-N
XLogP2.41
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-5-bromopyridine
CID 70622
6-bromo-3H-imidazo(4,5-b)pyridine-2-thiol
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CID 16414227
5-Bromopyridine-2,3-diamine
CID 691156
6-bromo-3H-imidazo[4,5-b]pyridin-2-ol
CID 1924413
2-N-methylpyridine-2,3-diamine
CID 12343669
6-Bromo-1,3-dimethyl-1h-imidazo[4,5-b]pyridin-2(3h)-one
CID 665048
N-(2-amino-5-bromo-3-pyridinyl)-N-benzylideneamine
CID 838785
2-(Piperazin-1-yl)pyridin-3-amine
CID 10397358
1-(3-Bromopyridin-2-yl)-4-methylpiperazine
CID 12203911
1-(3-Bromopyridin-2-yl)piperazine
CID 13298529
N''-Cyano-N-cyclopropyl-N'-pyridin-3-ylguanidine
CID 100534

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine?
The IUPAC name of 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine (CID 61228482) is 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine.
What is the SMILES notation for 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine?
The canonical SMILES for 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine is CCN(c1ncc(Br)cc1N)C1CC1.
What is the InChIKey of 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine?
The InChIKey is OBEMTYVPAILEFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3/c1-2-14(8-3-4-8)10-9(12)5-7(11)6-13-10/h5-6,8H,2-4,12H2,1H3.
What are the key properties of 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine?
5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine has a molecular weight of 256.15 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine is sourced from PubChem (CID 61228482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).