1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol

C12H26N2O2 — CID 115718079

IUPAC1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol
SMILESCCC(NCC(O)CN(C)C)C1CCOC1
InChIInChI=1S/C12H26N2O2/c1-4-12(10-5-6-16-9-10)13-7-11(15)8-14(2)3/h10-13,15H,4-9H2,1-3H3
InChIKeyDKFPZIWBPCYLKN-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.31
Rot. Bonds7

About 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol

1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol (PubChem CID 115718079) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol
PubChem CID115718079
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol
SMILESCCC(NCC(O)CN(C)C)C1CCOC1
InChIInChI=1S/C12H26N2O2/c1-4-12(10-5-6-16-9-10)13-7-11(15)8-14(2)3/h10-13,15H,4-9H2,1-3H3
InChIKeyDKFPZIWBPCYLKN-UHFFFAOYSA-N
XLogP0.31
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[1-(oxolan-3-yl)propylamino]methyl]pentan-1-ol
CID 115727563
1-N,1-N,3-trimethyl-2-N-[1-(oxolan-3-yl)propyl]butane-1,2-diamine
CID 113260390
1-(dicyclopropylmethylamino)-3-(dimethylamino)propan-2-ol
CID 61479607
N-[1-(oxolan-3-yl)propyl]pentan-1-amine
CID 115705770
6-[1-(oxolan-3-yl)propylamino]hexan-1-ol
CID 115906779
2,2-dimethyl-3-[1-(oxolan-3-yl)propylamino]propan-1-ol
CID 115894970
N-ethyl-N'-methyl-N',1-bis(oxolan-3-yl)ethane-1,2-diamine
CID 104746914
N'-cyclopentyl-N-ethyl-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104744659
N'-butan-2-yl-N,N'-diethyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104744742
2-(dimethylamino)-2-ethyl-1-(oxolan-3-yl)butan-1-ol
CID 79061948
N-(2-ethoxyethyl)-1-(oxolan-3-yl)propan-1-amine
CID 115709966
2-[[1-(oxolan-3-yl)propylamino]methyl]cyclopentan-1-ol
CID 115724703

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol (CID 115718079) is 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol is CCC(NCC(O)CN(C)C)C1CCOC1.
What is the InChIKey of 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol?
The InChIKey is DKFPZIWBPCYLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-12(10-5-6-16-9-10)13-7-11(15)8-14(2)3/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol?
1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol has a molecular weight of 230.35 g/mol, XLogP of 0.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-[1-(oxolan-3-yl)propylamino]propan-2-ol is sourced from PubChem (CID 115718079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).