N-chloropyridin-2-amine

C5H5ClN2 — CID 22481248

IUPACN-chloropyridin-2-amine
SMILESClNc1ccccn1
InChIInChI=1S/C5H5ClN2/c6-8-5-3-1-2-4-7-5/h1-4H,(H,7,8)
InChIKeyBVPSSZAVUQHOML-UHFFFAOYSA-N
MW128.56 g/mol
LogP1.65
Rot. Bonds1

About N-chloropyridin-2-amine

N-chloropyridin-2-amine (PubChem CID 22481248) has the molecular formula C5H5ClN2 and a molecular weight of 128.56 g/mol. Its IUPAC name is N-chloropyridin-2-amine.

Molecular Properties

Compound NameN-chloropyridin-2-amine
PubChem CID22481248
Molecular FormulaC5H5ClN2
Molecular Weight128.56 g/mol
Exact Mass128.01
IUPAC NameN-chloropyridin-2-amine
SMILESClNc1ccccn1
InChIInChI=1S/C5H5ClN2/c6-8-5-3-1-2-4-7-5/h1-4H,(H,7,8)
InChIKeyBVPSSZAVUQHOML-UHFFFAOYSA-N
XLogP1.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.56
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 517616
1-N,4-N-dipyridin-2-ylbenzene-1,4-diamine
CID 139175237
potassium N-methanidylpyridin-2-amine
CID 153353371
methanol;N-methylpyridin-2-amine
CID 174971654
N-(4-chlorophenyl)pyridin-2-amine
CID 139075249
N-(3-chloropropyl)pyridin-2-amine
CID 22118637
ethane;1-methyl-2-pyridin-2-ylhydrazine
CID 144520197
N-[bis(phosphanyl)methyl]pyridin-2-amine
CID 118465849
N'-pyridin-2-ylmethanediamine
CID 115225472
dichlorocobalt;N-propan-2-ylpyridin-2-amine
CID 175191424
N-(4-chlorobutyl)pyridin-2-amine
CID 106845032
4,6-dichloro-1-N,3-N-dipyridin-2-ylbenzene-1,3-diamine
CID 4978947

Frequently Asked Questions

What is the IUPAC name of N-chloropyridin-2-amine?
The IUPAC name of N-chloropyridin-2-amine (CID 22481248) is N-chloropyridin-2-amine.
What is the SMILES notation for N-chloropyridin-2-amine?
The canonical SMILES for N-chloropyridin-2-amine is ClNc1ccccn1.
What is the InChIKey of N-chloropyridin-2-amine?
The InChIKey is BVPSSZAVUQHOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClN2/c6-8-5-3-1-2-4-7-5/h1-4H,(H,7,8).
What are the key properties of N-chloropyridin-2-amine?
N-chloropyridin-2-amine has a molecular weight of 128.56 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-chloropyridin-2-amine is sourced from PubChem (CID 22481248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).