(2R)-1-(oxan-3-yl)pentan-2-amine

C10H21NO — CID 58017386

IUPAC(2R)-1-(oxan-3-yl)pentan-2-amine
SMILESCCC[C@@H](N)CC1CCCOC1
InChIInChI=1S/C10H21NO/c1-2-4-10(11)7-9-5-3-6-12-8-9/h9-10H,2-8,11H2,1H3/t9?,10-/m1/s1
InChIKeyMKAWYOZVMJNCOV-QVDQXJPCSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds4

About (2R)-1-(oxan-3-yl)pentan-2-amine

(2R)-1-(oxan-3-yl)pentan-2-amine (PubChem CID 58017386) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2R)-1-(oxan-3-yl)pentan-2-amine.

Molecular Properties

Compound Name(2R)-1-(oxan-3-yl)pentan-2-amine
PubChem CID58017386
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2R)-1-(oxan-3-yl)pentan-2-amine
SMILESCCC[C@@H](N)CC1CCCOC1
InChIInChI=1S/C10H21NO/c1-2-4-10(11)7-9-5-3-6-12-8-9/h9-10H,2-8,11H2,1H3/t9?,10-/m1/s1
InChIKeyMKAWYOZVMJNCOV-QVDQXJPCSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Propan-2-yl)oxan-4-amine
CID 46785833
4-(Oxan-4-yl)butan-2-amine
CID 62386259
2-(2-Methylpropyl)oxan-4-amine
CID 64104920
(2,6-Dimethyloxan-4-yl)methanamine
CID 81852973
1-(Oxan-4-yl)propan-2-amine
CID 21054632
2-(Pentan-3-yl)oxan-4-amine
CID 64106641
1-(Oxan-3-yl)propan-1-amine
CID 65332455
2-(2-Methylpropyl)oxan-3-amine hydrochloride
CID 75423686
(2-(Propan-2-yl)oxan-4-yl)methanamine hydrochloride
CID 121552613
3-(Cyclohexylmethyl)oxan-4-amine hydrochloride
CID 165900997
rac-(2R,4S)-4-methyl-2-(oxan-4-yl)piperidine
CID 165942131
1-Cyclohexyl-4,4-difluoro-5-propan-2-yloxypentan-2-amine
CID 54123882

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(oxan-3-yl)pentan-2-amine?
The IUPAC name of (2R)-1-(oxan-3-yl)pentan-2-amine (CID 58017386) is (2R)-1-(oxan-3-yl)pentan-2-amine.
What is the SMILES notation for (2R)-1-(oxan-3-yl)pentan-2-amine?
The canonical SMILES for (2R)-1-(oxan-3-yl)pentan-2-amine is CCC[C@@H](N)CC1CCCOC1.
What is the InChIKey of (2R)-1-(oxan-3-yl)pentan-2-amine?
The InChIKey is MKAWYOZVMJNCOV-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-4-10(11)7-9-5-3-6-12-8-9/h9-10H,2-8,11H2,1H3/t9?,10-/m1/s1.
What are the key properties of (2R)-1-(oxan-3-yl)pentan-2-amine?
(2R)-1-(oxan-3-yl)pentan-2-amine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(oxan-3-yl)pentan-2-amine is sourced from PubChem (CID 58017386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).