N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide

C12H24N2 — CID 135258640

IUPACN,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide
SMILESC/N=C(/C1CCCCC1)N(C)C(C)C
InChIInChI=1S/C12H24N2/c1-10(2)14(4)12(13-3)11-8-6-5-7-9-11/h10-11H,5-9H2,1-4H3/b13-12-
InChIKeyJNKJBZVWTOJECE-SEYXRHQNSA-N
MW196.34 g/mol
LogP2.94
Rot. Bonds2

About N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide

N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide (PubChem CID 135258640) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide.

Molecular Properties

Compound NameN,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide
PubChem CID135258640
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide
SMILESC/N=C(/C1CCCCC1)N(C)C(C)C
InChIInChI=1S/C12H24N2/c1-10(2)14(4)12(13-3)11-8-6-5-7-9-11/h10-11H,5-9H2,1-4H3/b13-12-
InChIKeyJNKJBZVWTOJECE-SEYXRHQNSA-N
XLogP2.94
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide?
The IUPAC name of N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide (CID 135258640) is N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide.
What is the SMILES notation for N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide?
The canonical SMILES for N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide is C/N=C(/C1CCCCC1)N(C)C(C)C.
What is the InChIKey of N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide?
The InChIKey is JNKJBZVWTOJECE-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H24N2/c1-10(2)14(4)12(13-3)11-8-6-5-7-9-11/h10-11H,5-9H2,1-4H3/b13-12-.
What are the key properties of N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide?
N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide has a molecular weight of 196.34 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N-propan-2-ylcyclohexanecarboximidamide is sourced from PubChem (CID 135258640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).