(methylideneamino)-piperidin-1-ylmethanol

C7H14N2O — CID 159673764

IUPAC(methylideneamino)-piperidin-1-ylmethanol
SMILESC=NC(O)N1CCCCC1
InChIInChI=1S/C7H14N2O/c1-8-7(10)9-5-3-2-4-6-9/h7,10H,1-6H2
InChIKeyQLGMBAPBDYOSEI-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.45
Rot. Bonds2

About (methylideneamino)-piperidin-1-ylmethanol

(methylideneamino)-piperidin-1-ylmethanol (PubChem CID 159673764) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (methylideneamino)-piperidin-1-ylmethanol.

Molecular Properties

Compound Name(methylideneamino)-piperidin-1-ylmethanol
PubChem CID159673764
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(methylideneamino)-piperidin-1-ylmethanol
SMILESC=NC(O)N1CCCCC1
InChIInChI=1S/C7H14N2O/c1-8-7(10)9-5-3-2-4-6-9/h7,10H,1-6H2
InChIKeyQLGMBAPBDYOSEI-UHFFFAOYSA-N
XLogP0.45
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

amino(piperidin-1-yl)methanol
CID 91080151
(1S)-1-piperidin-1-ylethanol
CID 86312531
1-penta-1,4-dien-3-ylpiperidine;hydrochloride
CID 173077168
(2R,3R)-3-piperidin-1-ylbutan-2-ol
CID 51980607
amino(pyrrolidin-1-yl)methanol
CID 57207139
methoxy(piperidin-1-yl)methanol
CID 90453688
2-pyrrolidin-1-ylpropanedial
CID 130025725
ethene;1-propan-2-ylpiperidine
CID 177325228
(2S,3R)-3-pyrrolidin-1-ylbutan-2-ol
CID 59057792
(1S)-1-pyrrolidin-1-ylethane-1,2-diol
CID 143982374
1-(4-methylpent-3-en-2-yl)piperidine
CID 134268073
1,1-di(piperidin-1-yl)but-3-en-2-ylsilane
CID 174047782

Frequently Asked Questions

What is the IUPAC name of (methylideneamino)-piperidin-1-ylmethanol?
The IUPAC name of (methylideneamino)-piperidin-1-ylmethanol (CID 159673764) is (methylideneamino)-piperidin-1-ylmethanol.
What is the SMILES notation for (methylideneamino)-piperidin-1-ylmethanol?
The canonical SMILES for (methylideneamino)-piperidin-1-ylmethanol is C=NC(O)N1CCCCC1.
What is the InChIKey of (methylideneamino)-piperidin-1-ylmethanol?
The InChIKey is QLGMBAPBDYOSEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-8-7(10)9-5-3-2-4-6-9/h7,10H,1-6H2.
What are the key properties of (methylideneamino)-piperidin-1-ylmethanol?
(methylideneamino)-piperidin-1-ylmethanol has a molecular weight of 142.20 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (methylideneamino)-piperidin-1-ylmethanol is sourced from PubChem (CID 159673764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).