N-cyclohexyl-N-methylpropanimidamide

C10H20N2 — CID 63178469

IUPACN-cyclohexyl-N-methylpropanimidamide
SMILES[H]/N=C(\CC)N(C)C1CCCCC1
InChIInChI=1S/C10H20N2/c1-3-10(11)12(2)9-7-5-4-6-8-9/h9,11H,3-8H2,1-2H3/b11-10+
InChIKeyHQPFUUICUHJJSD-ZHACJKMWSA-N
MW168.28 g/mol
LogP2.64
Rot. Bonds2

About N-cyclohexyl-N-methylpropanimidamide

N-cyclohexyl-N-methylpropanimidamide (PubChem CID 63178469) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-cyclohexyl-N-methylpropanimidamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methylpropanimidamide
PubChem CID63178469
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-cyclohexyl-N-methylpropanimidamide
SMILES[H]/N=C(\CC)N(C)C1CCCCC1
InChIInChI=1S/C10H20N2/c1-3-10(11)12(2)9-7-5-4-6-8-9/h9,11H,3-8H2,1-2H3/b11-10+
InChIKeyHQPFUUICUHJJSD-ZHACJKMWSA-N
XLogP2.64
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.64
H-Bond Donors ≤ 51
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-cyclohexyl-N-methylpropanimidamide?
The IUPAC name of N-cyclohexyl-N-methylpropanimidamide (CID 63178469) is N-cyclohexyl-N-methylpropanimidamide.
What is the SMILES notation for N-cyclohexyl-N-methylpropanimidamide?
The canonical SMILES for N-cyclohexyl-N-methylpropanimidamide is [H]/N=C(\CC)N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methylpropanimidamide?
The InChIKey is HQPFUUICUHJJSD-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-10(11)12(2)9-7-5-4-6-8-9/h9,11H,3-8H2,1-2H3/b11-10+.
What are the key properties of N-cyclohexyl-N-methylpropanimidamide?
N-cyclohexyl-N-methylpropanimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methylpropanimidamide is sourced from PubChem (CID 63178469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).