N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide

C12H25N3 — CID 63725872

IUPACN-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide
SMILES[H]/N=C(/C1CCCCC1)N(C)CCN(C)C
InChIInChI=1S/C12H25N3/c1-14(2)9-10-15(3)12(13)11-7-5-4-6-8-11/h11,13H,4-10H2,1-3H3/b13-12-
InChIKeyMMJBKPJZAPRXTK-SEYXRHQNSA-N
MW211.35 g/mol
LogP2.04
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide

N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide (PubChem CID 63725872) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide
PubChem CID63725872
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC NameN-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide
SMILES[H]/N=C(/C1CCCCC1)N(C)CCN(C)C
InChIInChI=1S/C12H25N3/c1-14(2)9-10-15(3)12(13)11-7-5-4-6-8-11/h11,13H,4-10H2,1-3H3/b13-12-
InChIKeyMMJBKPJZAPRXTK-SEYXRHQNSA-N
XLogP2.04
TPSA30.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
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-methyl-N-(3-methylbutyl)cyclopentanecarboximidamide
CID 63177358
N-(2-methoxyethyl)-N-methylcyclopentanecarboximidamide
CID 63177944
N-(2,2-dimethylpropyl)-N-methylcyclohexanecarboximidamide
CID 63177816
N-methyl-N-(2-pyridin-4-ylethyl)cyclohexanecarboximidamide
CID 63175381
N-methyl-N-(2-methylbutyl)cyclohexanecarboximidamide
CID 63175585
N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboxamide
CID 110482195
N-methyl-N-(oxan-3-ylmethyl)cyclohexanecarboximidamide
CID 63707933
N-cyclopentyl-N-ethylcyclohexanecarboximidamide
CID 63175660
N-(cyclopropylmethyl)-N-methylcyclopropanecarboximidamide
CID 63177015
N-methyl-N-(2-methylbutan-2-yl)cyclopentanecarboximidamide
CID 63962537
N-[(2-bromophenyl)methyl]-N-methylcyclohexanecarboximidamide
CID 63177867
N-(1-cyclopropylethyl)-N-methylcyclohexanecarboximidamide
CID 63176218

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide (CID 63725872) is N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide is [H]/N=C(/C1CCCCC1)N(C)CCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide?
The InChIKey is MMJBKPJZAPRXTK-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H25N3/c1-14(2)9-10-15(3)12(13)11-7-5-4-6-8-11/h11,13H,4-10H2,1-3H3/b13-12-.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide?
N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide has a molecular weight of 211.35 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-methylcyclohexanecarboximidamide is sourced from PubChem (CID 63725872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).