N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine

C11H25NO — CID 62597643

IUPACN-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine
SMILESCCCC(C)NCCOC(C)(C)C
InChIInChI=1S/C11H25NO/c1-6-7-10(2)12-8-9-13-11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyQASYMFOOGONJGP-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.58
Rot. Bonds6

About N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine

N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine (PubChem CID 62597643) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine.

Molecular Properties

Compound NameN-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine
PubChem CID62597643
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC NameN-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine
SMILESCCCC(C)NCCOC(C)(C)C
InChIInChI=1S/C11H25NO/c1-6-7-10(2)12-8-9-13-11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyQASYMFOOGONJGP-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.58
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-[2-[(2-methylpropan-2-yl)oxy]ethylamino]propan-1-ol
CID 112588775
1-N,1-N-dimethyl-2-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,2-diamine
CID 112589367
ethyl 2-[2-[(2-methylpropan-2-yl)oxy]ethylamino]propanoate
CID 112691084
N-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]pentan-2-amine
CID 102723313
2-methyl-4-(pentan-2-ylamino)butan-2-ol
CID 79361894
tert-butyl 3-(pentan-2-ylamino)propanoate
CID 46318488
N-(2-octoxyethyl)pentan-2-amine
CID 55196861
N-(2-undecoxyethyl)pentan-2-amine
CID 22091507
1-[(2-methylpropan-2-yl)oxy]-N-propylheptan-4-amine
CID 112590468
N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
CID 62560843
N-(3-propoxypropyl)pentan-2-amine
CID 82940850
tert-butyl N-[3-(pentan-2-ylamino)propyl]carbamate
CID 81344324

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine?
The IUPAC name of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine (CID 62597643) is N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine.
What is the SMILES notation for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine?
The canonical SMILES for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine is CCCC(C)NCCOC(C)(C)C.
What is the InChIKey of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine?
The InChIKey is QASYMFOOGONJGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-6-7-10(2)12-8-9-13-11(3,4)5/h10,12H,6-9H2,1-5H3.
What are the key properties of N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine?
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine has a molecular weight of 187.33 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine is sourced from PubChem (CID 62597643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).