N-(cyclopentylmethyl)-N-ethylethanimidamide

C10H20N2 — CID 143578979

IUPACN-(cyclopentylmethyl)-N-ethylethanimidamide
SMILES[H]/N=C(\C)N(CC)CC1CCCC1
InChIInChI=1S/C10H20N2/c1-3-12(9(2)11)8-10-6-4-5-7-10/h10-11H,3-8H2,1-2H3/b11-9+
InChIKeyROKMFCBEXQXRQK-PKNBQFBNSA-N
MW168.28 g/mol
LogP2.50
Rot. Bonds3

About N-(cyclopentylmethyl)-N-ethylethanimidamide

N-(cyclopentylmethyl)-N-ethylethanimidamide (PubChem CID 143578979) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-ethylethanimidamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-ethylethanimidamide
PubChem CID143578979
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-(cyclopentylmethyl)-N-ethylethanimidamide
SMILES[H]/N=C(\C)N(CC)CC1CCCC1
InChIInChI=1S/C10H20N2/c1-3-12(9(2)11)8-10-6-4-5-7-10/h10-11H,3-8H2,1-2H3/b11-9+
InChIKeyROKMFCBEXQXRQK-PKNBQFBNSA-N
XLogP2.50
TPSA27.09 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 ≤ 52.50
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'}

Analyze N-(cyclopentylmethyl)-N-ethylethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-ethylethanimidamide?
The IUPAC name of N-(cyclopentylmethyl)-N-ethylethanimidamide (CID 143578979) is N-(cyclopentylmethyl)-N-ethylethanimidamide.
What is the SMILES notation for N-(cyclopentylmethyl)-N-ethylethanimidamide?
The canonical SMILES for N-(cyclopentylmethyl)-N-ethylethanimidamide is [H]/N=C(\C)N(CC)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-ethylethanimidamide?
The InChIKey is ROKMFCBEXQXRQK-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-12(9(2)11)8-10-6-4-5-7-10/h10-11H,3-8H2,1-2H3/b11-9+.
What are the key properties of N-(cyclopentylmethyl)-N-ethylethanimidamide?
N-(cyclopentylmethyl)-N-ethylethanimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-ethylethanimidamide is sourced from PubChem (CID 143578979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).