2-methyl-2-(2-phenoxyethyl)pentan-1-amine

C14H23NO — CID 62726316

IUPAC2-methyl-2-(2-phenoxyethyl)pentan-1-amine
SMILESCCCC(C)(CN)CCOc1ccccc1
InChIInChI=1S/C14H23NO/c1-3-9-14(2,12-15)10-11-16-13-7-5-4-6-8-13/h4-8H,3,9-12,15H2,1-2H3
InChIKeySGHURMSOSFFBBG-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.22
Rot. Bonds7

About 2-methyl-2-(2-phenoxyethyl)pentan-1-amine

2-methyl-2-(2-phenoxyethyl)pentan-1-amine (PubChem CID 62726316) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-methyl-2-(2-phenoxyethyl)pentan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(2-phenoxyethyl)pentan-1-amine
PubChem CID62726316
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-methyl-2-(2-phenoxyethyl)pentan-1-amine
SMILESCCCC(C)(CN)CCOc1ccccc1
InChIInChI=1S/C14H23NO/c1-3-9-14(2,12-15)10-11-16-13-7-5-4-6-8-13/h4-8H,3,9-12,15H2,1-2H3
InChIKeySGHURMSOSFFBBG-UHFFFAOYSA-N
XLogP3.22
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-(2-phenylmethoxyethyl)pentan-1-amine
CID 130537173
3,3-bis(chloromethyl)hexoxybenzene
CID 79447958
1-amino-2-methyl-5-phenoxypentan-2-ol
CID 64814632
3-methyl-1-phenoxypentan-3-ol
CID 139819683
2-(2-phenoxyethoxy)pentan-2-ol
CID 141202879
3,4-dimethyl-1-phenoxyhexan-3-amine
CID 115001414
CID 161224902
CID 161224902
azane;propoxybenzene
CID 66667480
3,4-dimethyl-1-phenoxypentan-3-amine
CID 114998451
2-ethyl-2-methyl-4-phenoxy-N-propan-2-ylbutan-1-amine
CID 62724275
3-ethyl-1-phenoxyheptan-3-amine
CID 65020146
2,2-dimethyl-4-phenoxybutan-1-ol
CID 66024282

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-phenoxyethyl)pentan-1-amine?
The IUPAC name of 2-methyl-2-(2-phenoxyethyl)pentan-1-amine (CID 62726316) is 2-methyl-2-(2-phenoxyethyl)pentan-1-amine.
What is the SMILES notation for 2-methyl-2-(2-phenoxyethyl)pentan-1-amine?
The canonical SMILES for 2-methyl-2-(2-phenoxyethyl)pentan-1-amine is CCCC(C)(CN)CCOc1ccccc1.
What is the InChIKey of 2-methyl-2-(2-phenoxyethyl)pentan-1-amine?
The InChIKey is SGHURMSOSFFBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-3-9-14(2,12-15)10-11-16-13-7-5-4-6-8-13/h4-8H,3,9-12,15H2,1-2H3.
What are the key properties of 2-methyl-2-(2-phenoxyethyl)pentan-1-amine?
2-methyl-2-(2-phenoxyethyl)pentan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 3.22, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-phenoxyethyl)pentan-1-amine is sourced from PubChem (CID 62726316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).