N-methyl-1-propan-2-yloxyundecan-2-amine

C15H33NO — CID 105013250

IUPACN-methyl-1-propan-2-yloxyundecan-2-amine
SMILESCCCCCCCCCC(COC(C)C)NC
InChIInChI=1S/C15H33NO/c1-5-6-7-8-9-10-11-12-15(16-4)13-17-14(2)3/h14-16H,5-13H2,1-4H3
InChIKeyJKIHOBXQMFDUAP-UHFFFAOYSA-N
MW243.43 g/mol
LogP4.14
Rot. Bonds12

About N-methyl-1-propan-2-yloxyundecan-2-amine

N-methyl-1-propan-2-yloxyundecan-2-amine (PubChem CID 105013250) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is N-methyl-1-propan-2-yloxyundecan-2-amine.

Molecular Properties

Compound NameN-methyl-1-propan-2-yloxyundecan-2-amine
PubChem CID105013250
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC NameN-methyl-1-propan-2-yloxyundecan-2-amine
SMILESCCCCCCCCCC(COC(C)C)NC
InChIInChI=1S/C15H33NO/c1-5-6-7-8-9-10-11-12-15(16-4)13-17-14(2)3/h14-16H,5-13H2,1-4H3
InChIKeyJKIHOBXQMFDUAP-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 54.14
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

1-propan-2-yloxydecan-2-ylhydrazine
CID 105294338
1-ethoxy-N-methyltridecan-2-amine
CID 105008040
N-methylheptadecan-9-amine;hydrochloride
CID 175813537
N-methylundecan-4-amine
CID 60996531
N-methyloctadecan-3-amine
CID 150460863
N-methyldecan-3-amine
CID 60996977
N-methyl-1-propan-2-yloxyhept-6-yn-2-amine
CID 105179473
N-methyl-1-(2,2,2-trifluoroethoxy)undecan-2-amine
CID 103214874
(2S)-1-methoxy-N-methylhexan-2-amine
CID 177242292
2-(methylamino)hexadecan-1-ol
CID 118696061
carbanide;N-methyltridecan-3-amine;vanadium
CID 170975865
N,3-dimethylundecan-5-amine
CID 115833416

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-propan-2-yloxyundecan-2-amine?
The IUPAC name of N-methyl-1-propan-2-yloxyundecan-2-amine (CID 105013250) is N-methyl-1-propan-2-yloxyundecan-2-amine.
What is the SMILES notation for N-methyl-1-propan-2-yloxyundecan-2-amine?
The canonical SMILES for N-methyl-1-propan-2-yloxyundecan-2-amine is CCCCCCCCCC(COC(C)C)NC.
What is the InChIKey of N-methyl-1-propan-2-yloxyundecan-2-amine?
The InChIKey is JKIHOBXQMFDUAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-5-6-7-8-9-10-11-12-15(16-4)13-17-14(2)3/h14-16H,5-13H2,1-4H3.
What are the key properties of N-methyl-1-propan-2-yloxyundecan-2-amine?
N-methyl-1-propan-2-yloxyundecan-2-amine has a molecular weight of 243.43 g/mol, XLogP of 4.14, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-propan-2-yloxyundecan-2-amine is sourced from PubChem (CID 105013250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).