N'-(cyclopentylmethyl)-2-methylpropanimidamide

C10H20N2 — CID 63175775

IUPACN'-(cyclopentylmethyl)-2-methylpropanimidamide
SMILESCC(C)/C(N)=N\CC1CCCC1
InChIInChI=1S/C10H20N2/c1-8(2)10(11)12-7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyOJMIHPAIRQCPQH-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.19
Rot. Bonds3

About N'-(cyclopentylmethyl)-2-methylpropanimidamide

N'-(cyclopentylmethyl)-2-methylpropanimidamide (PubChem CID 63175775) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N'-(cyclopentylmethyl)-2-methylpropanimidamide.

Molecular Properties

Compound NameN'-(cyclopentylmethyl)-2-methylpropanimidamide
PubChem CID63175775
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN'-(cyclopentylmethyl)-2-methylpropanimidamide
SMILESCC(C)/C(N)=N\CC1CCCC1
InChIInChI=1S/C10H20N2/c1-8(2)10(11)12-7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyOJMIHPAIRQCPQH-UHFFFAOYSA-N
XLogP2.19
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.19
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'-(cyclopentylmethyl)-2-methylpropanimidamide?
The IUPAC name of N'-(cyclopentylmethyl)-2-methylpropanimidamide (CID 63175775) is N'-(cyclopentylmethyl)-2-methylpropanimidamide.
What is the SMILES notation for N'-(cyclopentylmethyl)-2-methylpropanimidamide?
The canonical SMILES for N'-(cyclopentylmethyl)-2-methylpropanimidamide is CC(C)/C(N)=N\CC1CCCC1.
What is the InChIKey of N'-(cyclopentylmethyl)-2-methylpropanimidamide?
The InChIKey is OJMIHPAIRQCPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-8(2)10(11)12-7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H2,11,12).
What are the key properties of N'-(cyclopentylmethyl)-2-methylpropanimidamide?
N'-(cyclopentylmethyl)-2-methylpropanimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopentylmethyl)-2-methylpropanimidamide is sourced from PubChem (CID 63175775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).