N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine

C14H23NO — CID 62108020

IUPACN-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine
SMILESCCCNCC(OC(C)C)c1ccccc1
InChIInChI=1S/C14H23NO/c1-4-10-15-11-14(16-12(2)3)13-8-6-5-7-9-13/h5-9,12,14-15H,4,10-11H2,1-3H3
InChIKeyXFDLVWXRPCDONP-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.15
Rot. Bonds7

About N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine

N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine (PubChem CID 62108020) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine
PubChem CID62108020
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC NameN-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine
SMILESCCCNCC(OC(C)C)c1ccccc1
InChIInChI=1S/C14H23NO/c1-4-10-15-11-14(16-12(2)3)13-8-6-5-7-9-13/h5-9,12,14-15H,4,10-11H2,1-3H3
InChIKeyXFDLVWXRPCDONP-UHFFFAOYSA-N
XLogP3.15
TPSA21.26 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 ≤ 53.15
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-[2-(3-chlorophenyl)-2-propan-2-yloxyethyl]propan-1-amine
CID 55036653
N-(2-phenoxy-2-phenylethyl)propan-1-amine
CID 62452576
2-butan-2-yloxy-N-ethyl-2-phenylethanamine
CID 62108738
N-[2-(2-methylsulfanylphenoxy)-2-phenylethyl]propan-1-amine
CID 63647905
N-[2-(3-bromophenyl)-2-butan-2-yloxyethyl]propan-1-amine
CID 55036561
N-[2-(3,4-dichlorophenoxy)-2-phenylethyl]propan-1-amine
CID 63498262
N-[2-(2-fluoro-3-methylphenoxy)-2-phenylethyl]propan-1-amine
CID 107661150
N-[2-[2-(3-methoxypropoxy)ethoxy]-2-phenylethyl]propan-1-amine
CID 103180489
3-methoxy-2-phenyl-N-propylpropan-1-amine
CID 103984694
[2-[(2-phenyl-2-propan-2-yloxyethyl)disulfanyl]-1-propan-2-yloxyethyl]benzene
CID 14612801
N-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]-2-phenylethyl]propan-1-amine
CID 81341788
N-[2-(4-chlorophenyl)-2-(1,1,1-trifluoropropan-2-yloxy)ethyl]propan-1-amine
CID 66275084

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine?
The IUPAC name of N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine (CID 62108020) is N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine.
What is the SMILES notation for N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine?
The canonical SMILES for N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine is CCCNCC(OC(C)C)c1ccccc1.
What is the InChIKey of N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine?
The InChIKey is XFDLVWXRPCDONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-10-15-11-14(16-12(2)3)13-8-6-5-7-9-13/h5-9,12,14-15H,4,10-11H2,1-3H3.
What are the key properties of N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine?
N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine is sourced from PubChem (CID 62108020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).