3-[[methyl(propyl)amino]methyl]pentan-3-ol

C10H23NO — CID 115927293

IUPAC3-[[methyl(propyl)amino]methyl]pentan-3-ol
SMILESCCCN(C)CC(O)(CC)CC
InChIInChI=1S/C10H23NO/c1-5-8-11(4)9-10(12,6-2)7-3/h12H,5-9H2,1-4H3
InChIKeyDSWUONHIZFWRSE-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.88
Rot. Bonds6

About 3-[[methyl(propyl)amino]methyl]pentan-3-ol

3-[[methyl(propyl)amino]methyl]pentan-3-ol (PubChem CID 115927293) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 3-[[methyl(propyl)amino]methyl]pentan-3-ol.

Molecular Properties

Compound Name3-[[methyl(propyl)amino]methyl]pentan-3-ol
PubChem CID115927293
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name3-[[methyl(propyl)amino]methyl]pentan-3-ol
SMILESCCCN(C)CC(O)(CC)CC
InChIInChI=1S/C10H23NO/c1-5-8-11(4)9-10(12,6-2)7-3/h12H,5-9H2,1-4H3
InChIKeyDSWUONHIZFWRSE-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[methyl(3-methylbutyl)amino]methyl]pentan-3-ol
CID 115919417
3-[[(3-amino-4-methylpentyl)-methylamino]methyl]pentan-3-ol
CID 114496644
N,2,2-trimethyl-N-propylbutan-1-amine
CID 58772817
2-ethyl-2-[[methyl(propyl)amino]methyl]butan-1-ol
CID 62270573
N,2,2-trimethyl-N-propylpentan-1-amine
CID 143480097
2-(bromomethyl)-N-methyl-N,2-dipropylpentan-1-amine
CID 65005368
1-N,2-N,2-trimethyl-1-N-propylpropane-1,2-diamine
CID 62848218
N,N'-dimethyl-N'-[2-[methyl(propyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 162082787
2-methyl-2-[[methyl(propyl)amino]methyl]butanal
CID 62275627
3-(aminomethyl)-6-[2,2-dimethylpropyl(methyl)amino]hexan-3-ol
CID 106811265
2,2-difluoro-N'-methyl-N'-propylpropane-1,3-diamine
CID 165462267
2-[methyl(propyl)amino]ethylazanium
CID 154557311

Frequently Asked Questions

What is the IUPAC name of 3-[[methyl(propyl)amino]methyl]pentan-3-ol?
The IUPAC name of 3-[[methyl(propyl)amino]methyl]pentan-3-ol (CID 115927293) is 3-[[methyl(propyl)amino]methyl]pentan-3-ol.
What is the SMILES notation for 3-[[methyl(propyl)amino]methyl]pentan-3-ol?
The canonical SMILES for 3-[[methyl(propyl)amino]methyl]pentan-3-ol is CCCN(C)CC(O)(CC)CC.
What is the InChIKey of 3-[[methyl(propyl)amino]methyl]pentan-3-ol?
The InChIKey is DSWUONHIZFWRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-8-11(4)9-10(12,6-2)7-3/h12H,5-9H2,1-4H3.
What are the key properties of 3-[[methyl(propyl)amino]methyl]pentan-3-ol?
3-[[methyl(propyl)amino]methyl]pentan-3-ol has a molecular weight of 173.30 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[methyl(propyl)amino]methyl]pentan-3-ol is sourced from PubChem (CID 115927293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).