CID 57429991

C5H10NO — CID 57429991

IUPAC—
SMILESCOC1CC[N]C1
InChIInChI=1S/C5H10NO/c1-7-5-2-3-6-4-5/h5H,2-4H2,1H3
InChIKeyDCFFYTMXPCXSBZ-UHFFFAOYSA-N
MW100.14 g/mol
LogP0.01
Rot. Bonds1

About CID 57429991

CID 57429991 (PubChem CID 57429991) has the molecular formula C5H10NO and a molecular weight of 100.14 g/mol.

Molecular Properties

Compound NameCID 57429991
PubChem CID57429991
Molecular FormulaC5H10NO
Molecular Weight100.14 g/mol
Exact Mass100.08
IUPAC Name—
SMILESCOC1CC[N]C1
InChIInChI=1S/C5H10NO/c1-7-5-2-3-6-4-5/h5H,2-4H2,1H3
InChIKeyDCFFYTMXPCXSBZ-UHFFFAOYSA-N
XLogP0.01
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.14
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-[(Oxiran-2-yl)methyl]pyrrolidine
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2-(3-Methoxypyrrolidin-1-yl)ethan-1-ol
CID 19039811
(3R)-3-methoxypyrrolidine hydrochloride
CID 45789898
(S)-3-methoxypyrrolidine hydrochloride
CID 45789911
3-Methoxypyrrolidin-1-amine
CID 46941551
1-(2-Methoxyethyl)pyrrolidin-3-ol
CID 55135411
3-Methoxypyrrolidine-1-sulfonyl chloride
CID 103532002
3-Butyl-1,3-oxazolidine
CID 12589268
1-(2-Methoxyethyl)pyrrolidine
CID 12183844

Frequently Asked Questions

What is the IUPAC name of CID 57429991?
The IUPAC name of CID 57429991 (CID 57429991) is not available.
What is the SMILES notation for CID 57429991?
The canonical SMILES for CID 57429991 is COC1CC[N]C1.
What is the InChIKey of CID 57429991?
The InChIKey is DCFFYTMXPCXSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO/c1-7-5-2-3-6-4-5/h5H,2-4H2,1H3.
What are the key properties of CID 57429991?
CID 57429991 has a molecular weight of 100.14 g/mol, XLogP of 0.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57429991 is sourced from PubChem (CID 57429991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).