1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol

C12H26N2O2 — CID 64820006

IUPAC1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol
SMILESCCN(CC(O)(CN)C1CC1)C(C)COC
InChIInChI=1S/C12H26N2O2/c1-4-14(10(2)7-16-3)9-12(15,8-13)11-5-6-11/h10-11,15H,4-9,13H2,1-3H3
InChIKeyYNZXQIOVYLYPKJ-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.44
Rot. Bonds8

About 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol

1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol (PubChem CID 64820006) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol
PubChem CID64820006
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol
SMILESCCN(CC(O)(CN)C1CC1)C(C)COC
InChIInChI=1S/C12H26N2O2/c1-4-14(10(2)7-16-3)9-12(15,8-13)11-5-6-11/h10-11,15H,4-9,13H2,1-3H3
InChIKeyYNZXQIOVYLYPKJ-UHFFFAOYSA-N
XLogP0.44
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-cyclopropyl-2-(ethylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]propanoate
CID 63910545
methyl 2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]-2-(methylamino)propanoate
CID 63910940
1-amino-2-cyclopropyl-3-methoxypropan-2-ol
CID 64813573
2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
CID 64828099
1-amino-3-[bis(2-ethoxyethyl)amino]-2-cyclopropylpropan-2-ol
CID 82966232
1-amino-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-2-ol
CID 64821364
1-amino-2-cyclopropyl-3-[methyl(3-methylbutyl)amino]propan-2-ol
CID 64818466
1-amino-2-cyclopropyl-3-[cyclopropyl(methyl)amino]propan-2-ol
CID 64820350
1-cyclohexyl-2-[ethyl(1-methoxypropan-2-yl)amino]ethanol
CID 113449107
1-cyclopentyl-2-[ethyl(1-methoxypropan-2-yl)amino]ethanone
CID 104750248
N'-ethyl-2-methoxy-N'-(1-methoxypropan-2-yl)propane-1,3-diamine
CID 106114714
1-amino-2-cyclopropyl-3-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103181567

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol?
The IUPAC name of 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol (CID 64820006) is 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol.
What is the SMILES notation for 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol?
The canonical SMILES for 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol is CCN(CC(O)(CN)C1CC1)C(C)COC.
What is the InChIKey of 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol?
The InChIKey is YNZXQIOVYLYPKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-14(10(2)7-16-3)9-12(15,8-13)11-5-6-11/h10-11,15H,4-9,13H2,1-3H3.
What are the key properties of 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol?
1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol has a molecular weight of 230.35 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-cyclopropyl-3-[ethyl(1-methoxypropan-2-yl)amino]propan-2-ol is sourced from PubChem (CID 64820006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).