5-chloro-N,N-dimethylpyrimidin-2-amine

C6H8ClN3 — CID 593768

IUPAC5-chloro-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(Cl)cn1
InChIInChI=1S/C6H8ClN3/c1-10(2)6-8-3-5(7)4-9-6/h3-4H,1-2H3
InChIKeyNAMGQSSLAIYNCN-UHFFFAOYSA-N
MW157.60 g/mol
LogP1.20
Rot. Bonds1

About 5-chloro-N,N-dimethylpyrimidin-2-amine

5-chloro-N,N-dimethylpyrimidin-2-amine (PubChem CID 593768) has the molecular formula C6H8ClN3 and a molecular weight of 157.60 g/mol. Its IUPAC name is 5-chloro-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-N,N-dimethylpyrimidin-2-amine
PubChem CID593768
Molecular FormulaC6H8ClN3
Molecular Weight157.60 g/mol
Exact Mass157.04
IUPAC Name5-chloro-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(Cl)cn1
InChIInChI=1S/C6H8ClN3/c1-10(2)6-8-3-5(7)4-9-6/h3-4H,1-2H3
InChIKeyNAMGQSSLAIYNCN-UHFFFAOYSA-N
XLogP1.20
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.60
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,5-Trichloropyrimidine
CID 237259
2-Pyrimidinamine, 5-chloro-
CID 79479
5-Fluoropyrimidine
CID 69605
2-Chloro-N,N-dimethylpyrimidin-4-amine
CID 95975
5-Chloropyrimidine-2-carbonitrile
CID 820198
5-Chloro-2-methoxypyrimidine
CID 142258
5-Chloropyrimidine
CID 12600384
Pyrimidine, 2,4-dichloro-5-methyl-
CID 74508
5-Methylpyrimidine
CID 74859
2,4-Dichloro-5-iodopyrimidine
CID 263438
2,4-Dichloro-5-fluoropyrimidine
CID 250705
5-Iodopyrimidine
CID 1201421

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 5-chloro-N,N-dimethylpyrimidin-2-amine (CID 593768) is 5-chloro-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 5-chloro-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 5-chloro-N,N-dimethylpyrimidin-2-amine is CN(C)c1ncc(Cl)cn1.
What is the InChIKey of 5-chloro-N,N-dimethylpyrimidin-2-amine?
The InChIKey is NAMGQSSLAIYNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3/c1-10(2)6-8-3-5(7)4-9-6/h3-4H,1-2H3.
What are the key properties of 5-chloro-N,N-dimethylpyrimidin-2-amine?
5-chloro-N,N-dimethylpyrimidin-2-amine has a molecular weight of 157.60 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 593768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).