N-(2,2-dimethylpropyl)oxan-3-amine

C10H21NO — CID 63360307

IUPACN-(2,2-dimethylpropyl)oxan-3-amine
SMILESCC(C)(C)CNC1CCCOC1
InChIInChI=1S/C10H21NO/c1-10(2,3)8-11-9-5-4-6-12-7-9/h9,11H,4-8H2,1-3H3
InChIKeyVTYOYGUBSMCOHZ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds2

About N-(2,2-dimethylpropyl)oxan-3-amine

N-(2,2-dimethylpropyl)oxan-3-amine (PubChem CID 63360307) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)oxan-3-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)oxan-3-amine
PubChem CID63360307
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-(2,2-dimethylpropyl)oxan-3-amine
SMILESCC(C)(C)CNC1CCCOC1
InChIInChI=1S/C10H21NO/c1-10(2,3)8-11-9-5-4-6-12-7-9/h9,11H,4-8H2,1-3H3
InChIKeyVTYOYGUBSMCOHZ-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-3-(oxan-3-ylamino)propanamide
CID 115978805
N-methyl-N'-(oxan-3-yl)methanediamine
CID 139447312
4,4-dimethyl-1-(oxan-3-ylamino)pentan-2-ol
CID 115721192
N-(2,2-dimethylpropyl)cyclododecanamine
CID 63452276
(3R)-N-methyloxan-3-amine
CID 58327948
(3S)-N-(cyclopentylmethyl)oxan-3-amine
CID 95305960
N-(2-methyl-2-piperidin-1-ylpropyl)oxolan-3-amine
CID 115688782
(3S)-N-(oxolan-3-ylmethyl)oxan-3-amine
CID 130735391
N-(2,2-diethylbutyl)oxolan-3-amine
CID 115694918
N-(2,2,3-trimethylbutyl)oxepan-4-amine
CID 102613607
2-N,2-N-diethyl-1-N-(oxan-3-yl)propane-1,2-diamine
CID 115708721
N-(2-ethoxyethyl)oxan-3-amine
CID 63363906

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)oxan-3-amine?
The IUPAC name of N-(2,2-dimethylpropyl)oxan-3-amine (CID 63360307) is N-(2,2-dimethylpropyl)oxan-3-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)oxan-3-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)oxan-3-amine is CC(C)(C)CNC1CCCOC1.
What is the InChIKey of N-(2,2-dimethylpropyl)oxan-3-amine?
The InChIKey is VTYOYGUBSMCOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(2,3)8-11-9-5-4-6-12-7-9/h9,11H,4-8H2,1-3H3.
What are the key properties of N-(2,2-dimethylpropyl)oxan-3-amine?
N-(2,2-dimethylpropyl)oxan-3-amine has a molecular weight of 171.28 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)oxan-3-amine is sourced from PubChem (CID 63360307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).