N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide

C10H14ClN3 — CID 172622138

IUPACN'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide
SMILESCc1cc(Cl)c(C)c(/N=C/N(C)C)n1
InChIInChI=1S/C10H14ClN3/c1-7-5-9(11)8(2)10(13-7)12-6-14(3)4/h5-6H,1-4H3/b12-6+
InChIKeyPBXBFAYLGNCNNQ-WUXMJOGZSA-N
MW211.70 g/mol
LogP2.57
Rot. Bonds2

About N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide

N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide (PubChem CID 172622138) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide
PubChem CID172622138
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC NameN'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide
SMILESCc1cc(Cl)c(C)c(/N=C/N(C)C)n1
InChIInChI=1S/C10H14ClN3/c1-7-5-9(11)8(2)10(13-7)12-6-14(3)4/h5-6H,1-4H3/b12-6+
InChIKeyPBXBFAYLGNCNNQ-WUXMJOGZSA-N
XLogP2.57
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-(3-cyano-6-methyl-2-pyridinyl)-N,N-dimethylmethanimidamide
CID 143498002
4-chloro-3,6-dimethylpyridin-2-amine;ethane
CID 172622326
N'-(3-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide
CID 25765
N'-(3-butyl-4-chloro-6-methyl-2-pyridinyl)methanimidamide
CID 139540632
N'-[2-(5-chloro-3,6-dimethyl-2-pyridinyl)-5-methylpyrazol-3-yl]-N,N-dimethylmethanimidamide
CID 73459082
N'-(5-bromo-3,4-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide
CID 146258283
N'-(4-chloro-3-methylphenyl)-N,N-dimethylmethanimidamide;ethane
CID 162381464
N'-(4-amino-6-chloro-1,3,5-triazin-2-yl)-N,N-dimethylmethanimidamide
CID 134106493
N'-(2,6-dichlorophenyl)-N,N-dimethylmethanimidamide;hydrochloride
CID 12678020
N'-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)-N,N-dimethylmethanimidamide
CID 535621
N'-(3,5-dibromo-4-methyl-2-pyridinyl)-N,N-dimethylmethanimidamide
CID 170732232
methyl 4-chloro-2-(dimethylaminomethylideneamino)pyridine-3-carboxylate
CID 177042843

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide?
The IUPAC name of N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide (CID 172622138) is N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide is Cc1cc(Cl)c(C)c(/N=C/N(C)C)n1.
What is the InChIKey of N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide?
The InChIKey is PBXBFAYLGNCNNQ-WUXMJOGZSA-N. The full InChI is InChI=1S/C10H14ClN3/c1-7-5-9(11)8(2)10(13-7)12-6-14(3)4/h5-6H,1-4H3/b12-6+.
What are the key properties of N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide?
N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide has a molecular weight of 211.70 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-3,6-dimethyl-2-pyridinyl)-N,N-dimethylmethanimidamide is sourced from PubChem (CID 172622138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).