4-aminopent-4-en-2-ol

C5H11NO — CID 88961101

IUPAC4-aminopent-4-en-2-ol
SMILESC=C(N)CC(C)O
InChIInChI=1S/C5H11NO/c1-4(6)3-5(2)7/h5,7H,1,3,6H2,2H3
InChIKeyODKOZODTERCFII-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.23
Rot. Bonds2

About 4-aminopent-4-en-2-ol

4-aminopent-4-en-2-ol (PubChem CID 88961101) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 4-aminopent-4-en-2-ol.

Molecular Properties

Compound Name4-aminopent-4-en-2-ol
PubChem CID88961101
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name4-aminopent-4-en-2-ol
SMILESC=C(N)CC(C)O
InChIInChI=1S/C5H11NO/c1-4(6)3-5(2)7/h5,7H,1,3,6H2,2H3
InChIKeyODKOZODTERCFII-UHFFFAOYSA-N
XLogP0.23
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dimethylhex-1-en-2-amine
CID 129255783
4-methylidenehex-5-en-2-ol
CID 13427514
4,5,6,7-tetramethyloct-1-en-2-amine
CID 155010763
prop-2-enyl 3-hydroxybutanoate
CID 14360290
(Z,6R)-2-amino-6-hydroxyhept-2-en-4-one
CID 55285585
6-methylhept-6-ene-2,4-diol
CID 57030596
hydroxylamine;propan-2-ol
CID 22024851
pent-4-en-2-ol;urea
CID 88650571
propane-1,2-diol;prop-2-enamide
CID 135223311
4-(2-methylpropyl)hepta-1,6-dien-2-amine
CID 138535342
2-(2-aminoprop-2-enyl)propanedioic acid
CID 87757863
2-methylpropane;prop-1-en-2-amine
CID 174893746

Frequently Asked Questions

What is the IUPAC name of 4-aminopent-4-en-2-ol?
The IUPAC name of 4-aminopent-4-en-2-ol (CID 88961101) is 4-aminopent-4-en-2-ol.
What is the SMILES notation for 4-aminopent-4-en-2-ol?
The canonical SMILES for 4-aminopent-4-en-2-ol is C=C(N)CC(C)O.
What is the InChIKey of 4-aminopent-4-en-2-ol?
The InChIKey is ODKOZODTERCFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-4(6)3-5(2)7/h5,7H,1,3,6H2,2H3.
What are the key properties of 4-aminopent-4-en-2-ol?
4-aminopent-4-en-2-ol has a molecular weight of 101.15 g/mol, XLogP of 0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopent-4-en-2-ol is sourced from PubChem (CID 88961101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).