N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine

C15H32N2 — CID 62257526

IUPACN-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCC(C)CNCC(C)(C)CN(C)C(C)C1CC1
InChIInChI=1S/C15H32N2/c1-12(2)9-16-10-15(4,5)11-17(6)13(3)14-7-8-14/h12-14,16H,7-11H2,1-6H3
InChIKeyAMEUBYSZJDETAF-UHFFFAOYSA-N
MW240.43 g/mol
LogP2.99
Rot. Bonds8

About N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine

N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine (PubChem CID 62257526) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine
PubChem CID62257526
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCC(C)CNCC(C)(C)CN(C)C(C)C1CC1
InChIInChI=1S/C15H32N2/c1-12(2)9-16-10-15(4,5)11-17(6)13(3)14-7-8-14/h12-14,16H,7-11H2,1-6H3
InChIKeyAMEUBYSZJDETAF-UHFFFAOYSA-N
XLogP2.99
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine?
The IUPAC name of N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine (CID 62257526) is N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine?
The canonical SMILES for N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine is CC(C)CNCC(C)(C)CN(C)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine?
The InChIKey is AMEUBYSZJDETAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-12(2)9-16-10-15(4,5)11-17(6)13(3)14-7-8-14/h12-14,16H,7-11H2,1-6H3.
What are the key properties of N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine?
N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine has a molecular weight of 240.43 g/mol, XLogP of 2.99, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N,2,2-trimethyl-N'-(2-methylpropyl)propane-1,3-diamine is sourced from PubChem (CID 62257526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).