N'-ethyl-N,N-di(propan-2-yl)ethanimidamide

C10H22N2 — CID 143948007

IUPACN'-ethyl-N,N-di(propan-2-yl)ethanimidamide
SMILESCC/N=C(\C)N(C(C)C)C(C)C
InChIInChI=1S/C10H22N2/c1-7-11-10(6)12(8(2)3)9(4)5/h8-9H,7H2,1-6H3/b11-10+
InChIKeyOBYYIPQWTWUSEK-ZHACJKMWSA-N
MW170.30 g/mol
LogP2.54
Rot. Bonds3

About N'-ethyl-N,N-di(propan-2-yl)ethanimidamide

N'-ethyl-N,N-di(propan-2-yl)ethanimidamide (PubChem CID 143948007) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-ethyl-N,N-di(propan-2-yl)ethanimidamide.

Molecular Properties

Compound NameN'-ethyl-N,N-di(propan-2-yl)ethanimidamide
PubChem CID143948007
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-ethyl-N,N-di(propan-2-yl)ethanimidamide
SMILESCC/N=C(\C)N(C(C)C)C(C)C
InChIInChI=1S/C10H22N2/c1-7-11-10(6)12(8(2)3)9(4)5/h8-9H,7H2,1-6H3/b11-10+
InChIKeyOBYYIPQWTWUSEK-ZHACJKMWSA-N
XLogP2.54
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.54
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'-ethyl-N,N-di(propan-2-yl)ethanimidamide?
The IUPAC name of N'-ethyl-N,N-di(propan-2-yl)ethanimidamide (CID 143948007) is N'-ethyl-N,N-di(propan-2-yl)ethanimidamide.
What is the SMILES notation for N'-ethyl-N,N-di(propan-2-yl)ethanimidamide?
The canonical SMILES for N'-ethyl-N,N-di(propan-2-yl)ethanimidamide is CC/N=C(\C)N(C(C)C)C(C)C.
What is the InChIKey of N'-ethyl-N,N-di(propan-2-yl)ethanimidamide?
The InChIKey is OBYYIPQWTWUSEK-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H22N2/c1-7-11-10(6)12(8(2)3)9(4)5/h8-9H,7H2,1-6H3/b11-10+.
What are the key properties of N'-ethyl-N,N-di(propan-2-yl)ethanimidamide?
N'-ethyl-N,N-di(propan-2-yl)ethanimidamide has a molecular weight of 170.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N,N-di(propan-2-yl)ethanimidamide is sourced from PubChem (CID 143948007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).