N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine

C15H28N2 — CID 63941075

IUPACN'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine
SMILESCCN(CCNC(C1CC1)C1CC1)CC1CC1
InChIInChI=1S/C15H28N2/c1-2-17(11-12-3-4-12)10-9-16-15(13-5-6-13)14-7-8-14/h12-16H,2-11H2,1H3
InChIKeyTVPSUPAEGFXQBW-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.50
Rot. Bonds9

About N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine

N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine (PubChem CID 63941075) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine
PubChem CID63941075
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine
SMILESCCN(CCNC(C1CC1)C1CC1)CC1CC1
InChIInChI=1S/C15H28N2/c1-2-17(11-12-3-4-12)10-9-16-15(13-5-6-13)14-7-8-14/h12-16H,2-11H2,1H3
InChIKeyTVPSUPAEGFXQBW-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine?
The IUPAC name of N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine (CID 63941075) is N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine.
What is the SMILES notation for N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine?
The canonical SMILES for N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine is CCN(CCNC(C1CC1)C1CC1)CC1CC1.
What is the InChIKey of N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine?
The InChIKey is TVPSUPAEGFXQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-2-17(11-12-3-4-12)10-9-16-15(13-5-6-13)14-7-8-14/h12-16H,2-11H2,1H3.
What are the key properties of N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine?
N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine has a molecular weight of 236.40 g/mol, XLogP of 2.50, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopropylmethyl)-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine is sourced from PubChem (CID 63941075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).