2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide

C18H22N2O — CID 165339340

IUPAC2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide
SMILESC=CCC(C(=O)NNC(C)C)c1ccc2ccccc2c1
InChIInChI=1S/C18H22N2O/c1-4-7-17(18(21)20-19-13(2)3)16-11-10-14-8-5-6-9-15(14)12-16/h4-6,8-13,17,19H,1,7H2,2-3H3,(H,20,21)
InChIKeyUQYIFAYPBAPIFB-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.53
Rot. Bonds6

About 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide

2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide (PubChem CID 165339340) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide.

Molecular Properties

Compound Name2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide
PubChem CID165339340
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide
SMILESC=CCC(C(=O)NNC(C)C)c1ccc2ccccc2c1
InChIInChI=1S/C18H22N2O/c1-4-7-17(18(21)20-19-13(2)3)16-11-10-14-8-5-6-9-15(14)12-16/h4-6,8-13,17,19H,1,7H2,2-3H3,(H,20,21)
InChIKeyUQYIFAYPBAPIFB-UHFFFAOYSA-N
XLogP3.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenylethyl (2R)-2-naphthalen-2-ylpent-4-enoate
CID 101472479
N-(2-amino-1-naphthalen-2-ylethyl)-2-prop-2-enylpent-4-enamide;hydrochloride
CID 120567542
[(1R)-1-naphthalen-2-ylbut-3-enyl] prop-2-enoate
CID 67366945
2-[4-(naphthalene-2-carbonyl)phenyl]pent-4-enoic acid
CID 21391762
N-[(1S)-1-naphthalen-2-ylethyl]prop-2-enamide
CID 101382734
4-methyl-2-naphthalen-2-ylpentanoic acid
CID 54477032
2-naphthalen-2-ylbutanoic acid
CID 27266
2-naphthalen-2-ylpropanehydrazide
CID 116843954
N-(2-amino-1-naphthalen-2-ylethyl)-2-(methanesulfonamido)propanamide;hydrochloride
CID 120567726
acetic acid;1-naphthalen-2-ylprop-2-en-1-ol
CID 70153213
N-(2-amino-1-naphthalen-2-ylethyl)-3-methylbutanamide
CID 120567667
2-naphthalen-2-yloxy-N-prop-2-enylpropanamide
CID 12873693

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide?
The IUPAC name of 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide (CID 165339340) is 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide.
What is the SMILES notation for 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide?
The canonical SMILES for 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide is C=CCC(C(=O)NNC(C)C)c1ccc2ccccc2c1.
What is the InChIKey of 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide?
The InChIKey is UQYIFAYPBAPIFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-4-7-17(18(21)20-19-13(2)3)16-11-10-14-8-5-6-9-15(14)12-16/h4-6,8-13,17,19H,1,7H2,2-3H3,(H,20,21).
What are the key properties of 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide?
2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide has a molecular weight of 282.39 g/mol, XLogP of 3.53, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yl-N'-propan-2-ylpent-4-enehydrazide is sourced from PubChem (CID 165339340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).