2-propyl-1,3-diazinan-2-ol

C7H16N2O — CID 139910638

IUPAC2-propyl-1,3-diazinan-2-ol
SMILESCCCC1(O)NCCCN1
InChIInChI=1S/C7H16N2O/c1-2-4-7(10)8-5-3-6-9-7/h8-10H,2-6H2,1H3
InChIKeyIRNOBXDTSNXEMZ-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.02
Rot. Bonds2

About 2-propyl-1,3-diazinan-2-ol

2-propyl-1,3-diazinan-2-ol (PubChem CID 139910638) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-propyl-1,3-diazinan-2-ol.

Molecular Properties

Compound Name2-propyl-1,3-diazinan-2-ol
PubChem CID139910638
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-propyl-1,3-diazinan-2-ol
SMILESCCCC1(O)NCCCN1
InChIInChI=1S/C7H16N2O/c1-2-4-7(10)8-5-3-6-9-7/h8-10H,2-6H2,1H3
InChIKeyIRNOBXDTSNXEMZ-UHFFFAOYSA-N
XLogP0.02
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dipropylpyrrolidine
CID 13332418
3-(2-propyl-1,3-diazinan-2-yl)propanal
CID 166921525
2,2-diethyl-1,3-diazinane
CID 55286866
(2S)-2-propylpiperidine-2-carboxylic acid
CID 101384273
2-prop-1-en-2-yl-2-propylazepane
CID 79179731
2-butyl-2-hexylpyrrolidine
CID 174534205
2-pent-3-ynyl-2-propylpyrrolidine
CID 104806327
methyl (2R)-2-propylpiperidine-2-carboxylate
CID 95169858
cyclopentyl-(2-propylpyrrolidin-2-yl)methanone
CID 106976587
2-ethenyl-2-propylazepane
CID 79116609
2-cyclopentyl-2-propylpyrrolidine
CID 66466252
2-butan-2-yl-2-propylpyrrolidine
CID 79443895

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1,3-diazinan-2-ol?
The IUPAC name of 2-propyl-1,3-diazinan-2-ol (CID 139910638) is 2-propyl-1,3-diazinan-2-ol.
What is the SMILES notation for 2-propyl-1,3-diazinan-2-ol?
The canonical SMILES for 2-propyl-1,3-diazinan-2-ol is CCCC1(O)NCCCN1.
What is the InChIKey of 2-propyl-1,3-diazinan-2-ol?
The InChIKey is IRNOBXDTSNXEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-2-4-7(10)8-5-3-6-9-7/h8-10H,2-6H2,1H3.
What are the key properties of 2-propyl-1,3-diazinan-2-ol?
2-propyl-1,3-diazinan-2-ol has a molecular weight of 144.22 g/mol, XLogP of 0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1,3-diazinan-2-ol is sourced from PubChem (CID 139910638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).