N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine

C11H24N2 — CID 61386704

IUPACN-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine
SMILESCCN(CCNC(C)(C)C)C1CC1
InChIInChI=1S/C11H24N2/c1-5-13(10-6-7-10)9-8-12-11(2,3)4/h10,12H,5-9H2,1-4H3
InChIKeyUCWIKIXUDRDWNA-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.86
Rot. Bonds5

About N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine

N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine (PubChem CID 61386704) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine
PubChem CID61386704
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine
SMILESCCN(CCNC(C)(C)C)C1CC1
InChIInChI=1S/C11H24N2/c1-5-13(10-6-7-10)9-8-12-11(2,3)4/h10,12H,5-9H2,1-4H3
InChIKeyUCWIKIXUDRDWNA-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine?
The IUPAC name of N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine (CID 61386704) is N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine.
What is the SMILES notation for N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine?
The canonical SMILES for N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine is CCN(CCNC(C)(C)C)C1CC1.
What is the InChIKey of N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine?
The InChIKey is UCWIKIXUDRDWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-13(10-6-7-10)9-8-12-11(2,3)4/h10,12H,5-9H2,1-4H3.
What are the key properties of N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine?
N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine is sourced from PubChem (CID 61386704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).