1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol

C10H21NO2 — CID 106676447

IUPAC1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol
SMILESCOC(C)(C)CC(O)CNC1CC1
InChIInChI=1S/C10H21NO2/c1-10(2,13-3)6-9(12)7-11-8-4-5-8/h8-9,11-12H,4-7H2,1-3H3
InChIKeyUEPKVCAEZQPFHU-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.91
Rot. Bonds6

About 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol

1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol (PubChem CID 106676447) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol
PubChem CID106676447
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol
SMILESCOC(C)(C)CC(O)CNC1CC1
InChIInChI=1S/C10H21NO2/c1-10(2,13-3)6-9(12)7-11-8-4-5-8/h8-9,11-12H,4-7H2,1-3H3
InChIKeyUEPKVCAEZQPFHU-UHFFFAOYSA-N
XLogP0.91
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-3-methoxypropan-2-ol
CID 21034992
1-(cyclooctylamino)-4,4-dimethylpentan-2-ol
CID 103784422
4,4-dimethyl-1-[(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 91662929
1-[(3-aminocyclopentyl)amino]-4,4-dimethylpentan-2-ol
CID 107151493
1-N-cyclopropyl-2-N-(3-methoxy-3-methylbutyl)propane-1,2-diamine
CID 103019940
4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol
CID 103784472
1-(cyclopropylamino)-3-ethoxypropan-2-ol
CID 43166145
N-[(2R)-4-methoxy-4-methylpentan-2-yl]cyclopropanamine
CID 29013814
(2S)-1-(cyclohexylamino)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 8741576
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
4,4-dimethyl-1-[(1-methylazepan-4-yl)amino]pentan-2-ol
CID 103859816
4-(cyclopropylamino)butane-1,3-diol
CID 117236694

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol (CID 106676447) is 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol is COC(C)(C)CC(O)CNC1CC1.
What is the InChIKey of 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol?
The InChIKey is UEPKVCAEZQPFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-10(2,13-3)6-9(12)7-11-8-4-5-8/h8-9,11-12H,4-7H2,1-3H3.
What are the key properties of 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol?
1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol has a molecular weight of 187.28 g/mol, XLogP of 0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-4-methoxy-4-methylpentan-2-ol is sourced from PubChem (CID 106676447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).