2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol

C12H26N2O2 — CID 64826962

IUPAC2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol
SMILESCOCCN(CCC(N)CO)C(C)C1CC1
InChIInChI=1S/C12H26N2O2/c1-10(11-3-4-11)14(7-8-16-2)6-5-12(13)9-15/h10-12,15H,3-9,13H2,1-2H3
InChIKeyAIGPNMRIKCBTKG-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.44
Rot. Bonds9

About 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol

2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol (PubChem CID 64826962) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol.

Molecular Properties

Compound Name2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol
PubChem CID64826962
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol
SMILESCOCCN(CCC(N)CO)C(C)C1CC1
InChIInChI=1S/C12H26N2O2/c1-10(11-3-4-11)14(7-8-16-2)6-5-12(13)9-15/h10-12,15H,3-9,13H2,1-2H3
InChIKeyAIGPNMRIKCBTKG-UHFFFAOYSA-N
XLogP0.44
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
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

2-(cyclopropylamino)-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol
CID 64825763
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-2-methylbutane-1,4-diamine
CID 81079207
3-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylpropan-1-ol
CID 115872820
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-2-methylpentane-1,5-diamine
CID 82016982
1-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol
CID 64820243
1-[1-cyclopropylethyl(2-methoxyethyl)amino]-3-methoxypropan-2-ol
CID 63928354
3-[1-cyclopropylethyl(2-methoxyethyl)amino]-1-(4-methylphenyl)propan-1-ol
CID 62617474
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
CID 62556804
3-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylpropanehydrazide
CID 63584231
1-cyclopropyl-N-(2-methoxyethyl)-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 55252268
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-pentan-3-ylethane-1,2-diamine
CID 55089014
2-cyclopropyl-2-(cyclopropylamino)-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-1-ol
CID 64826170

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol?
The IUPAC name of 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol (CID 64826962) is 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol.
What is the SMILES notation for 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol?
The canonical SMILES for 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol is COCCN(CCC(N)CO)C(C)C1CC1.
What is the InChIKey of 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol?
The InChIKey is AIGPNMRIKCBTKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(11-3-4-11)14(7-8-16-2)6-5-12(13)9-15/h10-12,15H,3-9,13H2,1-2H3.
What are the key properties of 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol?
2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol has a molecular weight of 230.35 g/mol, XLogP of 0.44, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol is sourced from PubChem (CID 64826962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).