N,N-dibenzylcyclopropanecarboximidamide

C18H20N2 — CID 63175386

IUPACN,N-dibenzylcyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H20N2/c19-18(17-11-12-17)20(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,17,19H,11-14H2/b19-18+
InChIKeyKVARXSFWYHLHDA-VHEBQXMUSA-N
MW264.37 g/mol
LogP4.08
Rot. Bonds5

About N,N-dibenzylcyclopropanecarboximidamide

N,N-dibenzylcyclopropanecarboximidamide (PubChem CID 63175386) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N,N-dibenzylcyclopropanecarboximidamide.

Molecular Properties

Compound NameN,N-dibenzylcyclopropanecarboximidamide
PubChem CID63175386
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC NameN,N-dibenzylcyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H20N2/c19-18(17-11-12-17)20(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,17,19H,11-14H2/b19-18+
InChIKeyKVARXSFWYHLHDA-VHEBQXMUSA-N
XLogP4.08
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.08
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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Related Compounds

1,1-dibenzylguanidine
CID 9487
benzyl(cyclopropylmethyl)carbamic acid
CID 68617171
N,N-dibenzylcyclohexanecarboxamide
CID 1371794
N-benzyl-N-(cyanomethyl)cyclopropanecarboxamide
CID 61035902
N-benzyl-N-[2-(dimethylamino)ethyl]cyclopropanecarboxamide
CID 60666282
N,N-dibenzyl-2-cyclopentylacetamide
CID 112760283
benzyl(cyclohexylmethyl)carbamic acid
CID 57063774
benzyl-[[(3S)-1-carbamimidoylpiperidin-3-yl]methyl]carbamic acid
CID 70047293
N,N-dibenzyl-2-(methylamino)prop-2-enimidamide
CID 146643292
N-benzyl-N-ethylbutanimidamide
CID 63175572
N-benzyl-N-ethyl-2-methylpropanimidamide
CID 63175573
3-amino-N-benzyl-N-(2-phenylethyl)cyclopentane-1-carboxamide
CID 119675945

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylcyclopropanecarboximidamide?
The IUPAC name of N,N-dibenzylcyclopropanecarboximidamide (CID 63175386) is N,N-dibenzylcyclopropanecarboximidamide.
What is the SMILES notation for N,N-dibenzylcyclopropanecarboximidamide?
The canonical SMILES for N,N-dibenzylcyclopropanecarboximidamide is [H]/N=C(\C1CC1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylcyclopropanecarboximidamide?
The InChIKey is KVARXSFWYHLHDA-VHEBQXMUSA-N. The full InChI is InChI=1S/C18H20N2/c19-18(17-11-12-17)20(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,17,19H,11-14H2/b19-18+.
What are the key properties of N,N-dibenzylcyclopropanecarboximidamide?
N,N-dibenzylcyclopropanecarboximidamide has a molecular weight of 264.37 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylcyclopropanecarboximidamide is sourced from PubChem (CID 63175386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).