2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol

C13H28N2O2 — CID 64828099

IUPAC2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
SMILESCCN(CC(C)(CO)NC1CC1)C(C)COC
InChIInChI=1S/C13H28N2O2/c1-5-15(11(2)8-17-4)9-13(3,10-16)14-12-6-7-12/h11-12,14,16H,5-10H2,1-4H3
InChIKeyIDEDZPWNVRICFY-UHFFFAOYSA-N
MW244.38 g/mol
LogP0.85
Rot. Bonds9

About 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol

2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol (PubChem CID 64828099) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
PubChem CID64828099
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
SMILESCCN(CC(C)(CO)NC1CC1)C(C)COC
InChIInChI=1S/C13H28N2O2/c1-5-15(11(2)8-17-4)9-13(3,10-16)14-12-6-7-12/h11-12,14,16H,5-10H2,1-4H3
InChIKeyIDEDZPWNVRICFY-UHFFFAOYSA-N
XLogP0.85
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol
CID 64825994
N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine
CID 55056516
2-(cyclopropylamino)-4-[2-methoxyethyl(pentan-3-yl)amino]-2-methylbutan-1-ol
CID 64825611
2-(cyclopropylamino)-2-methyl-3-[methyl(pentan-3-yl)amino]propan-1-ol
CID 64796626
6-[ethyl(1-methoxypropan-2-yl)amino]-2-methyl-2-(methylamino)hexan-1-ol
CID 64826103
3-[bis(2-methylpropyl)amino]-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64828074
1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol
CID 64820006
methyl 2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]-2-(methylamino)propanoate
CID 63910940
ethyl 2-cyclopropyl-2-(ethylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]propanoate
CID 63910545
2-(cyclopropylamino)-4-[ethyl(2-methoxyethyl)amino]-2-methylpentanoic acid
CID 64710862
2-(cyclopropylamino)-3-[1-cyclopropylethyl(methyl)amino]-2-methylpropan-1-ol
CID 64797072
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]propan-1-ol
CID 64798076

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol (CID 64828099) is 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol is CCN(CC(C)(CO)NC1CC1)C(C)COC.
What is the InChIKey of 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol?
The InChIKey is IDEDZPWNVRICFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-5-15(11(2)8-17-4)9-13(3,10-16)14-12-6-7-12/h11-12,14,16H,5-10H2,1-4H3.
What are the key properties of 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol?
2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol has a molecular weight of 244.38 g/mol, XLogP of 0.85, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol is sourced from PubChem (CID 64828099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).