2-[(dimethylamino)methyl]pentan-1-ol

C8H19NO — CID 117241783

IUPAC2-[(dimethylamino)methyl]pentan-1-ol
SMILESCCCC(CO)CN(C)C
InChIInChI=1S/C8H19NO/c1-4-5-8(7-10)6-9(2)3/h8,10H,4-7H2,1-3H3
InChIKeyVKMMEONNNQIFBF-UHFFFAOYSA-N
MW145.25 g/mol
LogP0.96
Rot. Bonds5

About 2-[(dimethylamino)methyl]pentan-1-ol

2-[(dimethylamino)methyl]pentan-1-ol (PubChem CID 117241783) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-[(dimethylamino)methyl]pentan-1-ol.

Molecular Properties

Compound Name2-[(dimethylamino)methyl]pentan-1-ol
PubChem CID117241783
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-[(dimethylamino)methyl]pentan-1-ol
SMILESCCCC(CO)CN(C)C
InChIInChI=1S/C8H19NO/c1-4-5-8(7-10)6-9(2)3/h8,10H,4-7H2,1-3H3
InChIKeyVKMMEONNNQIFBF-UHFFFAOYSA-N
XLogP0.96
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,5-trimethyl-2-propylhexan-1-amine
CID 123395746
2-[(dimethylamino)methyl]-N,N,N',N'-tetramethylpropane-1,3-diamine
CID 547455
4,8-bis(hydroxymethyl)undecan-6-one
CID 174613691
N,N-dimethyl-2-octyldodecan-1-amine
CID 21291112
N,N-dimethyl-2-nonylhenicosan-1-amine
CID 175192311
(2S)-2-propyldecan-1-ol
CID 10176571
2-propylheptadecan-1-ol
CID 137441509
2-propyldodecan-1-ol
CID 14438908
4,4-dimethyl-2-propylpentan-1-ol
CID 87272554
(2S)-2-propylheptane-1,7-diol
CID 118890038
(2R,4R)-4-methyl-2-propylhexan-1-ol
CID 92950667
2-propylpent-4-en-1-ol
CID 15525342

Frequently Asked Questions

What is the IUPAC name of 2-[(dimethylamino)methyl]pentan-1-ol?
The IUPAC name of 2-[(dimethylamino)methyl]pentan-1-ol (CID 117241783) is 2-[(dimethylamino)methyl]pentan-1-ol.
What is the SMILES notation for 2-[(dimethylamino)methyl]pentan-1-ol?
The canonical SMILES for 2-[(dimethylamino)methyl]pentan-1-ol is CCCC(CO)CN(C)C.
What is the InChIKey of 2-[(dimethylamino)methyl]pentan-1-ol?
The InChIKey is VKMMEONNNQIFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-4-5-8(7-10)6-9(2)3/h8,10H,4-7H2,1-3H3.
What are the key properties of 2-[(dimethylamino)methyl]pentan-1-ol?
2-[(dimethylamino)methyl]pentan-1-ol has a molecular weight of 145.25 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylamino)methyl]pentan-1-ol is sourced from PubChem (CID 117241783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).