CID 59901915

C5H9N — CID 59901915

IUPAC—
SMILES[CH]=C([CH]C)NC
InChIInChI=1S/C5H9N/c1-4-5(2)6-3/h2,4,6H,1,3H3
InChIKeyHPNMTNVOPZONHE-UHFFFAOYSA-N
MW83.13 g/mol
LogP0.75
Rot. Bonds2

About CID 59901915

CID 59901915 (PubChem CID 59901915) has the molecular formula C5H9N and a molecular weight of 83.13 g/mol.

Molecular Properties

Compound NameCID 59901915
PubChem CID59901915
Molecular FormulaC5H9N
Molecular Weight83.13 g/mol
Exact Mass83.07
IUPAC Name—
SMILES[CH]=C([CH]C)NC
InChIInChI=1S/C5H9N/c1-4-5(2)6-3/h2,4,6H,1,3H3
InChIKeyHPNMTNVOPZONHE-UHFFFAOYSA-N
XLogP0.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.13
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-fluoro-N-propylbut-1-en-2-amine
CID 88874456
(Z)-1-fluoro-N-methylbut-1-en-2-amine
CID 166762662
3-fluoro-N,3-dimethylbut-1-en-2-amine
CID 169996000
N-ethyl-3-fluorobut-1-en-2-amine
CID 170019433
3-fluoro-N-methylbut-1-en-2-amine
CID 145636376
N-methylprop-1-en-2-amine
CID 11007812
N-prop-1-en-2-ylpropan-1-amine
CID 15394288
N-ethylbut-1-en-2-amine
CID 18731820
(Z)-N-methylpent-2-en-3-amine
CID 20603015
(Z)-N-methylpent-2-en-2-amine
CID 20777465
N-methylcyclobuten-1-amine
CID 21830261
N,3-dimethylbut-1-en-2-amine
CID 22094906

Frequently Asked Questions

What is the IUPAC name of CID 59901915?
The IUPAC name of CID 59901915 (CID 59901915) is not available.
What is the SMILES notation for CID 59901915?
The canonical SMILES for CID 59901915 is [CH]=C([CH]C)NC.
What is the InChIKey of CID 59901915?
The InChIKey is HPNMTNVOPZONHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N/c1-4-5(2)6-3/h2,4,6H,1,3H3.
What are the key properties of CID 59901915?
CID 59901915 has a molecular weight of 83.13 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59901915 is sourced from PubChem (CID 59901915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).