2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol

C11H26N2O — CID 64798662

IUPAC2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(C)C(C)C
InChIInChI=1S/C11H26N2O/c1-6-7-12-11(4,9-14)8-13(5)10(2)3/h10,12,14H,6-9H2,1-5H3
InChIKeyMSWYCHWZKDBHRM-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.08
Rot. Bonds7

About 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol

2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol (PubChem CID 64798662) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
PubChem CID64798662
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(C)C(C)C
InChIInChI=1S/C11H26N2O/c1-6-7-12-11(4,9-14)8-13(5)10(2)3/h10,12,14H,6-9H2,1-5H3
InChIKeyMSWYCHWZKDBHRM-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64827091
3-[ethyl(propan-2-yl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64795479
3-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)propan-1-ol
CID 103192144
2-methyl-3-[pentyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
CID 64826760
3-[3,3-dimethylbutan-2-yl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
CID 64826895
2-methyl-5-[methyl(3-methylbutan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64796845
2-methyl-4-[methyl(2-methylbutan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64792229
2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64827986
3-[cyclopropylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64825469
2-methyl-3-propan-2-yloxy-2-(propylamino)propan-1-ol
CID 64804252
2-methyl-5-[methyl(2-methylpropyl)amino]-2-(propylamino)pentan-1-ol
CID 64796336
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826426

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol?
The IUPAC name of 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol (CID 64798662) is 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol.
What is the SMILES notation for 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol?
The canonical SMILES for 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol is CCCNC(C)(CO)CN(C)C(C)C.
What is the InChIKey of 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol?
The InChIKey is MSWYCHWZKDBHRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-6-7-12-11(4,9-14)8-13(5)10(2)3/h10,12,14H,6-9H2,1-5H3.
What are the key properties of 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol?
2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol has a molecular weight of 202.34 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 2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol is sourced from PubChem (CID 64798662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).