1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol

C12H26N2O — CID 115895807

IUPAC1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCCC(NCC(C)(O)CN(C)C)C1CC1
InChIInChI=1S/C12H26N2O/c1-5-11(10-6-7-10)13-8-12(2,15)9-14(3)4/h10-11,13,15H,5-9H2,1-4H3
InChIKeyARYPDPGNDBRPQU-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.08
Rot. Bonds7

About 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol

1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol (PubChem CID 115895807) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol
PubChem CID115895807
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCCC(NCC(C)(O)CN(C)C)C1CC1
InChIInChI=1S/C12H26N2O/c1-5-11(10-6-7-10)13-8-12(2,15)9-14(3)4/h10-11,13,15H,5-9H2,1-4H3
InChIKeyARYPDPGNDBRPQU-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(dimethylamino)-3-(hexan-3-ylamino)-2-methylpropan-2-ol
CID 115906563
1-[[cyclopropyl-(4-fluorophenyl)methyl]amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 103911427
5-(1-cyclopropylpropylamino)-4,4-dimethylpentan-1-ol
CID 103898995
N-(1-cyclopropylpropyl)hydroxylamine
CID 82686074
3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
CID 114150174
1-(1-aminopropan-2-ylamino)-3-(dimethylamino)-2-methylpropan-2-ol
CID 106145662
1-(dicyclopropylmethylamino)-2-methylbutan-2-ol
CID 65108113
1-(1-cyclopropylbutylamino)-2,3-dimethylpentan-2-ol
CID 115769996
1-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethylamino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106145431
1-(dimethylamino)-2-methyl-3-(spiro[3.5]nonan-3-ylamino)propan-2-ol
CID 106147471
1-(dimethylamino)-3-[(1-methoxy-3-methylbutan-2-yl)amino]-2-methylpropan-2-ol
CID 115895816
1-(dimethylamino)-3-[[(2R)-2-hydroxypropyl]amino]-2-methylpropan-2-ol
CID 106147817

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol (CID 115895807) is 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol is CCC(NCC(C)(O)CN(C)C)C1CC1.
What is the InChIKey of 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol?
The InChIKey is ARYPDPGNDBRPQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-11(10-6-7-10)13-8-12(2,15)9-14(3)4/h10-11,13,15H,5-9H2,1-4H3.
What are the key properties of 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol?
1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylpropylamino)-3-(dimethylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 115895807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).