N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine

C15H29NO — CID 55088152

IUPACN-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine
SMILESCC(C)CC(C)OCCNC(C1CC1)C1CC1
InChIInChI=1S/C15H29NO/c1-11(2)10-12(3)17-9-8-16-15(13-4-5-13)14-6-7-14/h11-16H,4-10H2,1-3H3
InChIKeyQQNVDLRHXPEMAI-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.22
Rot. Bonds9

About N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine

N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine (PubChem CID 55088152) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine
PubChem CID55088152
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine
SMILESCC(C)CC(C)OCCNC(C1CC1)C1CC1
InChIInChI=1S/C15H29NO/c1-11(2)10-12(3)17-9-8-16-15(13-4-5-13)14-6-7-14/h11-16H,4-10H2,1-3H3
InChIKeyQQNVDLRHXPEMAI-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490801
4-methyl-N-[2-(4-methylpentan-2-yloxy)ethyl]cyclohexan-1-amine
CID 62572197
N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine
CID 61480803
N-(dicyclopropylmethyl)-N'-methyl-N'-(2-propan-2-yloxyethyl)ethane-1,2-diamine
CID 81067423
N-(dicyclopropylmethyl)-2-piperidin-4-yloxyethanamine
CID 63902652
N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
CID 107094173
1-cyclopropyl-2-methyl-N-(2-propan-2-yloxyethyl)propan-1-amine
CID 104584711
N-(dicyclopropylmethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 55090020
N',N'-dimethyl-N-[2-(4-methylpentan-2-yloxy)ethyl]ethane-1,2-diamine
CID 62572976
N-(dicyclopropylmethyl)-N',N'-bis(3-methylbutyl)ethane-1,2-diamine
CID 107871429
N-[2-(4-methylpentan-2-yloxy)ethyl]hexan-1-amine
CID 62572811
3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine
CID 43362870

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine (CID 55088152) is N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine is CC(C)CC(C)OCCNC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine?
The InChIKey is QQNVDLRHXPEMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-11(2)10-12(3)17-9-8-16-15(13-4-5-13)14-6-7-14/h11-16H,4-10H2,1-3H3.
What are the key properties of N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine?
N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine has a molecular weight of 239.40 g/mol, XLogP of 3.22, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine is sourced from PubChem (CID 55088152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).