N-(2-methoxy-2-methylpropyl)nonan-2-amine

C14H31NO — CID 104759526

IUPACN-(2-methoxy-2-methylpropyl)nonan-2-amine
SMILESCCCCCCCC(C)NCC(C)(C)OC
InChIInChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(2)15-12-14(3,4)16-5/h13,15H,6-12H2,1-5H3
InChIKeyJQKXTDDQVQXXHC-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.75
Rot. Bonds10

About N-(2-methoxy-2-methylpropyl)nonan-2-amine

N-(2-methoxy-2-methylpropyl)nonan-2-amine (PubChem CID 104759526) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is N-(2-methoxy-2-methylpropyl)nonan-2-amine.

Molecular Properties

Compound NameN-(2-methoxy-2-methylpropyl)nonan-2-amine
PubChem CID104759526
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC NameN-(2-methoxy-2-methylpropyl)nonan-2-amine
SMILESCCCCCCCC(C)NCC(C)(C)OC
InChIInChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(2)15-12-14(3,4)16-5/h13,15H,6-12H2,1-5H3
InChIKeyJQKXTDDQVQXXHC-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.75
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

2-methyl-1-[[(2R)-nonan-2-yl]amino]propan-2-ol
CID 98118384
methyl 3-(heptan-2-ylamino)-2,2-dimethylpropanoate
CID 79623539
N-(2,2,2-trifluoroethyl)nonan-2-amine
CID 43129666
2,2-dimethyl-3-(octan-2-ylamino)propanoic acid
CID 79623645
4-[(2-methoxy-2-methylpropyl)amino]pentanoic acid
CID 104759577
1-(heptan-2-ylamino)-2,3-dimethylpentan-2-ol
CID 115719513
2-methoxy-2-methyl-N-propylundecan-4-amine
CID 103025043
N-[2-methyl-1-(nonan-2-ylamino)propan-2-yl]methanesulfonamide
CID 63858933
N-propylnonan-2-amine
CID 43129664
N-heptan-2-ylheptan-1-amine
CID 43572726
N-heptan-2-yldodecan-1-amine
CID 63491878
N-octan-2-ylundecan-1-amine
CID 150124606

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-methylpropyl)nonan-2-amine?
The IUPAC name of N-(2-methoxy-2-methylpropyl)nonan-2-amine (CID 104759526) is N-(2-methoxy-2-methylpropyl)nonan-2-amine.
What is the SMILES notation for N-(2-methoxy-2-methylpropyl)nonan-2-amine?
The canonical SMILES for N-(2-methoxy-2-methylpropyl)nonan-2-amine is CCCCCCCC(C)NCC(C)(C)OC.
What is the InChIKey of N-(2-methoxy-2-methylpropyl)nonan-2-amine?
The InChIKey is JQKXTDDQVQXXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(2)15-12-14(3,4)16-5/h13,15H,6-12H2,1-5H3.
What are the key properties of N-(2-methoxy-2-methylpropyl)nonan-2-amine?
N-(2-methoxy-2-methylpropyl)nonan-2-amine has a molecular weight of 229.41 g/mol, XLogP of 3.75, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-methylpropyl)nonan-2-amine is sourced from PubChem (CID 104759526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).